Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Index of species in the CCCBDB by IUPAC International Chemical Identifier (INChI)

For information on INChI see http://www.iupac.org/inchi/

Molecules in the CCCBDB

casno	formula	name	InChI	InChIkey	SMILES	sketch	other names
12385136	H-	Hydrogen atom anion	InChI=1S/H/q-1	KLGZELKXQMTEMM-UHFFFAOYSA-N	[H-]	H-	hydride
12385136	H	Hydrogen atom	InChI=1S/H	YZCKVEUIGOORGS-UHFFFAOYSA-N	[H]	H	H-atom; Hydrogen; Hydrogen atom; Hydrogen radical
12385136	H+	Hydrogen atom cation	InChI=1S/p+1	GPRLSGONYQIRFK-UHFFFAOYSA-N	[H+]	H+
16873179	D-	Deuterium atom anion	InChI=1S/H/q-1/i1+1	KLGZELKXQMTEMM-OUBTZVSYSA-N	[2H-]	D-
16873179	D	Deuterium atom	InChI=1S/H/i1+1	YZCKVEUIGOORGS-OUBTZVSYSA-N	[2H]	D	Deuterium; Deuterium atom
16873179	D+	Deuterium atom cation	InChI=1S/p+1/i/hD	GPRLSGONYQIRFK-DYCDLGHISA-N	[2H+]	D+
13983205	HD	Deuterium hydride	InChI=1S/H2/h1H/i1+1	UFHFLCQGNIYNRP-OUBTZVSYSA-N	[H][2H]		Deuterium hydride; Deuterium, mol. with hydrogen; Hydrogen-d1
7782390	D2	Deuterium diatomic	InChI=1S/H2/h1H/i1+1D	UFHFLCQGNIYNRP-VVKOMZTBSA-N	[2H][2H]		Deuterium; diduterium
1333740	H2-	hydrogen diatomic anion	InChI=1S/H2/h1H/q-1	MHQRCAMTVYPALZ-UHFFFAOYSA-N	[H][H-]
1333740	H2	Hydrogen diatomic	InChI=1S/H2/h1H	UFHFLCQGNIYNRP-UHFFFAOYSA-N	[H][H]		Hydrogen; Molecular hydrogen; o-Hydrogen; p-Hydrogen; dihydrogen
1333740	H2+	Hydrogen cation	InChI=1S/H2/h1H/q+1	ZZIJOQHRUPVPQC-UHFFFAOYSA-N	[H][H+]
28132481	H3+	hydrogen trimer cation	InChI=1S/H3/c1-2-3-1/q+1	RQZCXKHVAUFVMF-UHFFFAOYSA-N
7440597	He-	Helium atom anion	InChI=1S/He/q-1	GQCTUJCUOFABIY-UHFFFAOYSA-N	[He-]	He-
7440597	He	Helium atom	InChI=1S/He	SWQJXJOGLNCZEY-UHFFFAOYSA-N	[He]	He	Helium
7440597	He+	Helium atom cation	InChI=1S/He/q+1	QLNXTEZOQCZJBA-UHFFFAOYSA-N	[He+]	He+
9000184	He2+	helium diatomic cation	InChI=1S/He2/c1-2/q+1	ZAJTYDXIUNGESO-UHFFFAOYSA-N	[He][He+]
9000219	HeH	Helium hydride	InChI=1S/HHe/h1H	VFSHXFTVUHSLHV-UHFFFAOYSA-N	[HeH]
9000219	HeH+	Helium hydride cation	InChI=1S/HHe/h1H/q+1	HSFAAVLNFOAYQX-UHFFFAOYSA-N	[He][H+]
7439932	Li-	Lithium atom anion	InChI=1S/Li/q-1	VSRVKRSRQFOUEF-UHFFFAOYSA-N	[Li-]	Li-
7439932	Li	Lithium atom	InChI=1S/Li	WHXSMMKQMYFTQS-UHFFFAOYSA-N	[Li]	Li	Lithium
7439932	Li+	Lithium atom cation	InChI=1S/Li/q+1	HBBGRARXTFLTSG-UHFFFAOYSA-N	[Li+]	Li+
7580678	LiH-	lithium hydride anion	InChI=1S/Li.H/q-1;	ZQPORAMEHYRKLM-UHFFFAOYSA-N	[LiH-]
7580678	LiH	Lithium Hydride	InChI=1S/Li.H	SIAPCJWMELPYOE-UHFFFAOYSA-N	[LiH]		Hydrure de lithium; Lithium hydride; Lithium hydride (LiH)
7580678	LiH+	lithium hydride cation	InChI=1S/Li.H/q+1;	HSOYNNFNUCWPIZ-UHFFFAOYSA-N	[LiH+]
12162151	HeLi+	Helium Lithium cation	InChI=1S/He.Li/q;+1		[Li+][He]
7440417	Be-	Beryllium atom anion	InChI=1S/Be/q-1	MKUXRYYRAPCTSE-UHFFFAOYSA-N	[Be-]	Be-
7440417	Be	Beryllium atom	InChI=1S/Be	ATBAMAFKBVZNFJ-UHFFFAOYSA-N	[Be]	Be	Beryllium; Beryllium-9; Glucinium; Glucinum
7440417	Be+	Beryllium atom cation	InChI=1S/Be/q+1	FSZJGTOCGOQRRE-UHFFFAOYSA-N	[Be+]	Be+
13597972	BeH-	berylium monohydride anion	InChI=1S/Be.H/q-1;	XYJSQJZDMXOLES-UHFFFAOYSA-N	[BeH-]
13597972	BeH	beryllium monohydride	InChI=1S/Be.H	AYBCUKQQDUJLQN-UHFFFAOYSA-N	[BeH]		Beryllium hydride
13597972	BeH+	beryllium monohydride cation	InChI=1S/Be.H/q+1;	ZMHJNSGNHYXBAE-UHFFFAOYSA-N	[BeH+]
7787522	BeH2	beryllium dihydride	InChI=1S/Be.2H	RWASOQSEFLDYLC-UHFFFAOYSA-N	[BeH2]		Beryllium hydride
7787522	BeH2+	Beryllium dihydride cation	InChI=1S/Be.2H/q+1;;	LIYOQPNVGOXTMQ-UHFFFAOYSA-N	[BeH2+]
7787522	BeH2+	Beryllium dihydride cation	InChI=1S/Be.2H/q+1;;	LIYOQPNVGOXTMQ-UHFFFAOYSA-N	[BeH2+]
7440428	B-	Boron atom anion	InChI=1S/B/q-1	XGLYHUVZMIRFNT-UHFFFAOYSA-N	[B-]	B-
7440428	B	Boron atom	InChI=1S/B	ZOXJGFHDIHLPTG-UHFFFAOYSA-N	[B]	B	Boron
7440428	B+	Boron atom cation	InChI=1S/B/q+1	HYFJXBYGHMZZPQ-UHFFFAOYSA-N	[B+]	B+
13766262	BH-	boron monohydride anion	InChI=1S/BH/h1H/q-1	DBDNZCBRIPTLJF-UHFFFAOYSA-N	[BH-]
13766262	BH	Boron monohydride	InChI=1S/BH/h1H	UWBOAQKPEXKXSU-UHFFFAOYSA-N	[BH]		Borane; Borane(1)
13766262	BH+	boron monohydride cation	InChI=1S/BH/h1H/q+1	HJCAPRQJPXZNOT-UHFFFAOYSA-N	[BH+]
14452643	BH2-	boron dihydride anion	InChI=1S/BH2/h1H2/q-1	CBWJKNQKWLEEPG-UHFFFAOYSA-N	[BH2-]
14452643	BH2	boron dihydride	InChI=1S/BH2/h1H2	IOCVPZINIZVUIL-UHFFFAOYSA-N	[BH2]		BH2 Radical; Borane(2); Boron dihydride
14452643	BH2+	Boron dihydride cation	InChI=1S/BH2/h1H2/q+1	RCNJPCYKNBLHDC-UHFFFAOYSA-N	[BH2+]
13283313	BH3-	boron trihydride anion	InChI=1S/BH3/h1H3/q-1	RAGFTAWPNNEELE-UHFFFAOYSA-N	[BH3-]
13283313	BH3-	boron trihydride anion	InChI=1S/BH3/h1H3/q-1	RAGFTAWPNNEELE-UHFFFAOYSA-N	[BH3-]
13283313	BH3	boron trihydride	InChI=1S/BH3/h1H3	UORVGPXVDQYIDP-UHFFFAOYSA-N	B		Borane; Borane(3)
13283313	BH3+	boron trihydride cation	InChI=1S/BH3/h1H3/q+1	YXFJCDMOWXLUFT-UHFFFAOYSA-N	[BH3+]
13283313	BH3+	boron trihydride cation	InChI=1S/BH3/h1H3/q+1	YXFJCDMOWXLUFT-UHFFFAOYSA-N	[BH3+]
13283313	BH3+	boron trihydride cation	InChI=1S/BH3/h1H3/q+1	YXFJCDMOWXLUFT-UHFFFAOYSA-N	[BH3+]
16971292	BH4-	borohydride anion	InChI=1S/BH4/h1H4/q-1	CROBTXVXNQNKKO-UHFFFAOYSA-N	[BH4-]
16971292	BH4	borohydride	InChI=1S/BH4/h1H4	RPHDAPRHVMJYOJ-UHFFFAOYSA-N	[BH4]
16971292	BH4	borohydride	InChI=1S/BH4/h1H4	RPHDAPRHVMJYOJ-UHFFFAOYSA-N	[BH4]
7440440	C-	Carbon atom anion	InChI=1S/C/q-1	RTNCBHBYULLTCL-UHFFFAOYSA-N	[C-]	C-
7440440	C	Carbon atom	InChI=1S/C	OKTJSMMVPCPJKN-UHFFFAOYSA-N	[C]	C	Carbon
7440440	C+	Carbon atom cation	InChI=1S/C/q+1	GKDCRJWYAGBLFY-UHFFFAOYSA-N	[C+]	C+
3315375	CH-	methylidyne anion	InChI=1S/CH/h1H/q-1	VPIURJINGFGPNS-UHFFFAOYSA-N	[CH-]
3315375	CH	Methylidyne	InChI=1S/CH/h1H	VRLIPUYDFBXWCH-UHFFFAOYSA-N	[CH]		Methylidyne
3315375	CH+	Methylidyne cation	InChI=1S/CH/h1H/q+1	WVVLBIYUCXYYEU-UHFFFAOYSA-N	[CH+]
2465567	CH2-	methylene anion	InChI=1S/CH2/h1H2/q-1	BBNHULVYDKYRSP-UHFFFAOYSA-N	[CH2-]
2465567	CH2	Methylene	InChI=1S/CH2/h1H2	HZVOZRGWRWCICA-UHFFFAOYSA-N	[CH2]		Methylene
2465567	CH2	Methylene	InChI=1S/CH2/h1H2	HZVOZRGWRWCICA-UHFFFAOYSA-N	[CH2]		Methylene
2465567	CH2+	methylene cation	InChI=1S/CH2/h1H2/q+1	CCOXZMOGYFFTRT-UHFFFAOYSA-N	[CH2+]
2465567	CH2+	methylene cation	InChI=1S/CH2/h1H2/q+1	CCOXZMOGYFFTRT-UHFFFAOYSA-N	[CH2+]
2229074	CH3-	methyl anion	InChI=1S/CH3/h1H3/q-1	LGRLWUINFJPLSH-UHFFFAOYSA-N	[CH3-]		methanide
2229074	CH3	Methyl radical	InChI=1S/CH3/h1H3	WCYWZMWISLQXQU-UHFFFAOYSA-N	[CH3]		Methyl; Methyl radical
2229074	CH3+	methyl cation	InChI=1S/CH3/h1H3/q+1	JUHDUIDUEUEQND-UHFFFAOYSA-N	[CH3+]
676802	CHD3	methane-d3	InChI=1S/CH4/h1H4/i1D3	VNWKTOKETHGBQD-FIBGUPNXSA-N	C
558203	CD4	methane-d4	InChI=1S/CH4/h1H4/i1D4	VNWKTOKETHGBQD-JQYAHLJZSA-N	C
676493	CH3D	methane-d	InChI=1S/CH4/h1H4/i1D	VNWKTOKETHGBQD-MICDWDOJSA-N	C
676551	CH2D2	methane-d2	InChI=1S/CH4/h1H4/i1D2	VNWKTOKETHGBQD-DICFDUPASA-N	C
74828	CH4-	Methane anion	InChI=1S/CH4/h1H4/q-1		[CH4-]
74828	CH4	Methane	InChI=1S/CH4/h1H4	VNWKTOKETHGBQD-UHFFFAOYSA-N	C		Biogas; Fire damp; Marsh gas; Methane; Methyl hydride; R 50
74828	CH4+	Methane cation	InChI=1S/CH4/h1H4/q+1	DEMLYXWOPCFOLG-UHFFFAOYSA-N	[CH4+]
74828	CH4+	Methane cation	InChI=1S/CH4/h1H4/q+1	DEMLYXWOPCFOLG-UHFFFAOYSA-N	[CH4+]
74828	CH4+	Methane cation	InChI=1S/CH4/h1H4/q+1	DEMLYXWOPCFOLG-UHFFFAOYSA-N	[CH4+]
17778880	N-	Nitrogen atom anion	InChI=1S/N/q-1	AODRJISUPXKQJP-UHFFFAOYSA-N	[N-]	N-
17778880	N	Nitrogen atom	InChI=1S/N	QJGQUHMNIGDVPM-UHFFFAOYSA-N	[N]	N	N; Nitrogen atom; Nitrogen radical; nitrogen
17778880	N+	Nitrogen atom cation	InChI=1S/N/q+1	DELRCXTYJVVNEW-UHFFFAOYSA-N	[N+]	N+
13774920	NH-	Imidogen anion	InChI=1S/HN/h1H/q-1	NUENPMRHRIHXSZ-UHFFFAOYSA-N	[NH-]
13774920	NH	Imidogen	InChI=1S/HN/h1H	PDCKRJPYJMCOFO-UHFFFAOYSA-N	[NH]		Imidogen; Imino
13774920	NH+	imidogen cation	InChI=1S/HN/h1H/q+1	RCELGLLFWPQDDS-UHFFFAOYSA-N	[NH+]
13770406	NH2-	amino anion	InChI=1S/H2N/h1H2/q-1	HYGWNUKOUCZBND-UHFFFAOYSA-N	[NH2-]		amide
13770406	NH2	Amino radical	InChI=1S/H2N/h1H2	MDFFNEOEWAXZRQ-UHFFFAOYSA-N	[NH2]		Amidogen; Amino radical
13770406	NH2+	Amino cation	InChI=1S/H2N/h1H2/q+1	QTLMMXDMXKCANI-UHFFFAOYSA-N	[NH2+]
15117847	ND2	Amidogen-d2	InChI=1S/H2N/h1H2/i1D2	MDFFNEOEWAXZRQ-DICFDUPASA-N	[N]([2H])[2H]		Amidogen-D2
13550497	ND3	Ammonia-d3	InChI=1S/H3N/h1H3/i/hD3	QGZKDVFQNNGYKY-ZRLBSURWSA-N	N([2H])([2H])[2H]		Ammonia-d3-
7664417	NH3-	Ammonia anion	InChI=1S/H3N/h1H3/q-1	TZXQEDWSXMUPRS-UHFFFAOYSA-N	[NH3-]
7664417	NH3	Ammonia	InChI=1S/H3N/h1H3	QGZKDVFQNNGYKY-UHFFFAOYSA-N	N		Ammonia; Ammonia gas; Ammonia, anhydrous; Anhydrous ammonia; Aromatic Ammonia, Vaporole; Nitro-Sil; Spirit of Hartshorn; azane
7664417	NH3+	ammonia cation	InChI=1S/H3N/h1H3/q+1	FXDYOSCCLBVICI-UHFFFAOYSA-N	[NH3+]
14798039	NH4	Ammonium radical	InChI=1S/H4N/h1H4		[NH4]		Nitrogen tetrahydride
14798039	NH4+	ammonium cation	InChI=1S/H3N/h1H3/p+1	QGZKDVFQNNGYKY-UHFFFAOYSA-O	[NH4+]		ammonium
17778802	O-	Oxygen atom anion	InChI=1S/O/q-1	SUNFGZRUFCAYCR-UHFFFAOYSA-N	[O-]	O-
17778802	O	Oxygen atom	InChI=1S/O	QVGXLLKOCUKJST-UHFFFAOYSA-N	[O]	O	Atomic oxygen; Oxygen; Oxygen atom; Oxygen(sup 3P); Oxygen, atomic; Photooxygen; Singlet oxygen
17778802	O+	Oxygen atom cation	InChI=1S/O/q+1	KLZXPVWVDXGFTD-UHFFFAOYSA-N	[O+]	O+
13587547	DO	Hydroxyl-d	InChI=1S/HO/h1H/i1D	TUJKJAMUKRIRHC-MICDWDOJSA-N	[2HO]		Hydroxyl-D
3352576	OH-	hydroxide anion	InChI=1S/H2O/h1H2/p-1	XLYOFNOQVPJJNP-UHFFFAOYSA-M	[OH-]		Hydroxyl anion; Hydroxyl; hydroxide
3352576	OH	Hydroxyl radical	InChI=1S/HO/h1H	TUJKJAMUKRIRHC-UHFFFAOYSA-N	[OH]		Hydroxy radical; Hydroxyl; Hydroxy
3352576	OH+	hydoxyl cation	InChI=1S/HO/h1H/q+1	MSCUNRCIQGLERU-UHFFFAOYSA-N	[OH+]
14940637	HDO	Water-d1	InChI=1S/H2O/h1H2/i/hD	XLYOFNOQVPJJNP-DYCDLGHISA-N	O[2H]		Water-D1
7732185	H2O-	water anion	InChI=1S/H2O/h1H2/q-1	UJCLDIPWNLPWIV-UHFFFAOYSA-N	[OH2-]
7732185	H2O-	water anion	InChI=1S/H2O/h1H2/q-1	UJCLDIPWNLPWIV-UHFFFAOYSA-N	[OH2-]
7732185	H2O	Water	InChI=1S/H2O/h1H2	XLYOFNOQVPJJNP-UHFFFAOYSA-N	O		Dihydrogen oxide; Distilled water; Ice; Water vapor; Water; oxidane
7732185	H2O+	water cation	InChI=1S/H2O/h1H2/q+1	RECVMTHOQWMYFX-UHFFFAOYSA-N	[OH2+]
7789200	D2O	Deuterium oxide	InChI=1S/H2O/h1H2/i/hD2	XLYOFNOQVPJJNP-ZSJDYOACSA-N	O([2H])[2H]		Deuterium oxide; Dideuterium oxide; Heavy water; Heavy water-d2; Water(sup 2)-H2; Water, heavy; Water-d2
13968086	H3O+	hydronium cation	InChI=1S/H2O/h1H2/p+1	XLYOFNOQVPJJNP-UHFFFAOYSA-O	[OH3+]		oxonium; Oxidanium; hydronium
14762948	F-	Fluorine atom anion	InChI=1S/FH/h1H/p-1	KRHYYFGTRYWZRS-UHFFFAOYSA-M	[F-]	F-	fluoride
14762948	F	Fluorine atom	InChI=1S/F	YCKRFDGAMUMZLT-UHFFFAOYSA-N	F	F	Fluorine atom; Fluorine radical; fluorine
14762948	F+	Fluorine atom cation	InChI=1S/F/q+1	LMHDQOWNISVSPD-UHFFFAOYSA-N	[F+]	F+
14333267	DF	Hydrofluoric acid-d	InChI=1S/FH/h1H/i/hD	KRHYYFGTRYWZRS-DYCDLGHISA-N	F[2H]		Deuterium fluoride; Hydrofluoric acid-d
7664393	HF-	hydrogen fluoride anion	InChI=1S/FH/h1H/q-1	AVYKNYBXEAFLBK-UHFFFAOYSA-N	[FH-]
7664393	HF	Hydrogen fluoride	InChI=1S/FH/h1H	KRHYYFGTRYWZRS-UHFFFAOYSA-N	F		Acide fluorhydrique; Acido fluoridrico; Anhydrous hydrofluoric acid; Fluoric acid; Fluorowodor; Fluorwasserstoff; Fluorwaterstof; Hydrofluoric acid; Hydrofluoride; Hydrogen fluoride; Rubigine
7664393	HF+	hydrogen fluoride cation	InChI=1S/FH/h1H/q+1	GCZNJFDPFDGYDB-UHFFFAOYSA-N	[FH+]
12206676	H2F+	dihydrogen fluoride cation	InChI=1S/FH2/h1H2/q+1	YNESUKSMQODWNS-UHFFFAOYSA-N	[FH2+]		fluoronium
7440019	Ne-	Neon atom anion	InChI=1S/Ne/q-1	OFRAWIXOCFNIFC-UHFFFAOYSA-N	[Ne-]	Ne-
7440019	Ne	Neon atom	InChI=1S/Ne	GKAOGPIIYCISHV-UHFFFAOYSA-N	[Ne]	Ne	Neon
7440019	Ne+	Neon atom cation	InChI=1S/Ne/q+1	LANGVOCUTJKVFC-UHFFFAOYSA-N	[Ne+]	Ne+
12200656	NeH	neon hydrogen	InChI=1S/HNe/h1H	LBMJGAHVDNLTQZ-UHFFFAOYSA-N	[NeH]
12200656	NeH+	neon hydrogen cation	InChI=1S/Ne/p+1	GKAOGPIIYCISHV-UHFFFAOYSA-O	[Ne].[H+]
7440235	Na-	Sodium atom anion	InChI=1S/Na/q-1	GVGHZEYNQYAORP-UHFFFAOYSA-N	[Na-]	Na-
7440235	Na	Sodium atom	InChI=1S/Na	KEAYESYHFKHZAL-UHFFFAOYSA-N	[Na]	Na	NA 1421; Natrium; Sodium
7440235	Na+	Sodium atom cation	InChI=1S/Na/q+1	FKNQFGJONOIPTF-UHFFFAOYSA-N	[Na+]	Na+
7646697	NaH-	sodium hydride anion	InChI=1S/Na.H/q-1;	JCISVDFVUVXSDD-UHFFFAOYSA-N	[Na][H-]
7646697	NaH	sodium hydride	InChI=1S/Na.H	MPMYQQHEHYDOCL-UHFFFAOYSA-N	[NaH]		NAH 80; Sodium hydride; Sodium hydride (NaH)
7646697	NaH+	sodium hydride cation	InChI=1S/Na.H/q+1;	FYDBACYJBJQTSN-UHFFFAOYSA-N	[Na][H+]
7439954	Mg-	Magnesium atom anion	InChI=1S/Mg/q-1	XUXSNMMFFZIQRU-UHFFFAOYSA-N	[Mg-]	Mg-
7439954	Mg	Magnesium atom	InChI=1S/Mg	FYYHWMGAXLPEAU-UHFFFAOYSA-N	[Mg]	Mg	Magnesio; Magnesium; Magnesium clippings; Magnesium pellets; Magnesium powder (pyrophoric); Magnesium powdered; Magnesium ribbons; Magnesium turnings; NA 1869; RMC
7439954	Mg+	Magnesium atom cation	InChI=1S/Mg/q+1	XYAGEBWLYIDCRX-UHFFFAOYSA-N	[Mg+]	Mg+
14332537	MgH-	magnesium monohydride anion	InChI=1S/Mg.H/q-1;	JICOAJQJSYTWQW-UHFFFAOYSA-N	[MgH-]
14332537	MgH-	magnesium monohydride anion	InChI=1/Mg.H/q-1;/rHMg/h1H/q-1	JICOAJQJSYTWQW-QZXZXGQDNA-N	[MgH-]
14332537	MgH	magnesium monohydride	InChI=1S/Mg.H	RZCHRULKKYOSQS-UHFFFAOYSA-N	[MgH]		Magnesium hydride
14332537	MgH+	magnesium monohydride cation	InChI=1S/Mg.H/q+1;	LMAKMUADRKEOEM-UHFFFAOYSA-N	[MgH+]
14332537	MgH+	magnesium monohydride cation	InChI=1/Mg.H/q+1;/rHMg/h1H/q+1	LMAKMUADRKEOEM-CLVLUJLJNA-N	[MgH+]
7693278	MgH2	magnesium dihydride	InChI=1S/Mg.2H	RSHAOIXHUHAZPM-UHFFFAOYSA-N	[MgH2]		Magnesium hydride
7429905	Al-	Aluminum atom anion	InChI=1S/Al/q-1	SBLSYFIUPXRQRY-UHFFFAOYSA-N	[Al-]	Al-
7429905	Al	Aluminum atom	InChI=1S/Al	XAGFODPZIPBFFR-UHFFFAOYSA-N	[Al]	Al	Alaun; Aluminium; Aluminum; Aluminum 27
7429905	Al+	Aluminum atom cation	InChI=1S/Al/q+1	KVLCHQHEQROXGN-UHFFFAOYSA-N	[Al+]	Al+
13967221	AlH-	aluminum monohydride anion	InChI=1S/Al.H/q-1;	GPPJFULYRSNYHE-UHFFFAOYSA-N	[AlH-]
13967221	AlH	aluminum monohydride	InChI=1S/Al.H	SPRIOUNJHPCKPV-UHFFFAOYSA-N	[AlH]		Aluminum hydride
13967221	AlH+	aluminum monohydride cation	InChI=1S/Al.H/q+1;	BSDSLUUQUQGTMP-UHFFFAOYSA-N	[AlH+]
13967221	AlH+	aluminum monohydride cation	InChI=1/Al.H/q+1;/rAlH/h1H/q+1	BSDSLUUQUQGTMP-SDLXDVTNNA-N	[AlH+]
14457659	AlH2-	aluminum dihydride anion	InChI=1S/Al.2H/q-1;;	QCBHFZBUEQBFNL-UHFFFAOYSA-N	[AlH2-]
14457659	AlH2-	aluminum dihydride anion	InChI=1/Al.2H/q-1;;/rAlH2/h1H2/q-1	QCBHFZBUEQBFNL-VTESIKLQNA-N	[AlH2-]
14457659	AlH2	aluminum dihydride	InChI=1S/Al.2H	AYENPGKIIRJZBT-UHFFFAOYSA-N	[AlH2]
14457659	AlH2+	aluminum dihydride cation	InChI=1S/Al.2H/q+1;;	GOQFGEHFZBDYEC-UHFFFAOYSA-N	[AlH2+]
14457659	AlH2+	aluminum dihydride cation	InChI=1/Al.2H/q+1;;/rAlH2/h1H2/q+1	GOQFGEHFZBDYEC-URGSOASMNA-N	[AlH2+]
7784216	AlH3-	aluminum trihydride anion	InChI=1S/Al.3H/q-1;;;	VCQUXTJZTDLELV-UHFFFAOYSA-N	[AlH3-]
7784216	AlH3-	aluminum trihydride anion	InChI=1/Al.3H/q-1;;;/rAlH3/h1H3/q-1	VCQUXTJZTDLELV-ACNMIOQWNA-N	[AlH3-]
7784216	AlH3-	aluminum trihydride anion	InChI=1S/Al.3H/q-1;;;	VCQUXTJZTDLELV-UHFFFAOYSA-N	[AlH3-]
7784216	AlH3	aluminum trihydride	InChI=1S/Al.3H	AZDRQVAHHNSJOQ-UHFFFAOYSA-N	[AlH3]		α-Aluminum trihydride; Alane; Aluminum hydride; Aluminum hydride (AlH3); Aluminum trihydride; alpha-Aluminum trihydride
7784216	AlH3	aluminum trihydride	InChI=1/Al.3H/rAlH3/h1H3	AZDRQVAHHNSJOQ-FSBNLZEDNA-N	[AlH3]		α-Aluminum trihydride; Alane; Aluminum hydride; Aluminum hydride (AlH3); Aluminum trihydride; alpha-Aluminum trihydride
7784216	AlH3+	aluminum trihydride cation	InChI=1S/Al.3H/q+1;;;	UGETZQQDAYQULB-UHFFFAOYSA-N	[AlH3+]
7784216	AlH3+	aluminum trihydride cation	InChI=1S/Al.3H/q+1;;;	UGETZQQDAYQULB-UHFFFAOYSA-N	[AlH3+]
19469819	AlH4-	Aluminum tetrahydride anion	InChI=1S/Al.4H/q-1;;;;	WVZWSVHLGBNEIG-UHFFFAOYSA-N	[Al-].[H].[H].[H].[H]
7440213	Si-	Silicon atom anion	InChI=1S/Si/q-1	HJELPJZFDFLHEY-UHFFFAOYSA-N	[Si-]	Si-
7440213	Si	Silicon atom	InChI=1S/Si	XUIMIQQOPSSXEZ-UHFFFAOYSA-N	[Si]	Si	Defoamer S-10; Silicon
7440213	Si+	Silicon atom cation	InChI=1S/Si/q+1	FSLGCYNKXXIWGJ-UHFFFAOYSA-N	[Si+]	Si+
13774942	SiH-	silicon monohydride anion	InChI=1S/HSi/h1H/q-1	YENZRLHDDWKZRA-UHFFFAOYSA-N	[SiH-]
13774942	SiH	Silylidyne	InChI=1S/HSi/h1H	QHGSGZLLHBKSAH-UHFFFAOYSA-N	[SiH]		Silicon hydride; Silylidyne
13774942	SiH+	silicon monohydride cation	InChI=1S/HSi/h1H/q+1	DNOWURJULUQXJY-UHFFFAOYSA-N	[SiH+]
13825906	SiH2-	silicon dihydride anion	InChI=1S/H2Si/h1H2/q-1	TXDGZDQGYYLGTJ-UHFFFAOYSA-N	[SiH2-]
13825906	SiH2	silicon dihydride	InChI=1S/H2Si/h1H2	XMIJDTGORVPYLW-UHFFFAOYSA-N	[SiH2]		Silylene; Silylene radical
13825906	SiH2+	silicon dihydride cation	InChI=1S/H2Si/h1H2/q+1	SYWMLUYLILUMRO-UHFFFAOYSA-N	[SiH2+]
13765441	SiH3-	Silyl anion	InChI=1S/H3Si/h1H3/q-1	LNVJLOIIRUIQCP-UHFFFAOYSA-N	[SiH3-]
13765441	SiH3	Silyl radical	InChI=1S/H3Si/h1H3	OLRJXMHANKMLTD-UHFFFAOYSA-N	[SiH3]		Silyl radical; silyl
13765441	SiH3+	Silyl cation	InChI=1S/H3Si/h1H3/q+1	SCABQASLNUQUKD-UHFFFAOYSA-N	[SiH3+]
13780319	SiH2D2	silane-d2	InChI=1S/H4Si/h1H4		[SiH2D2]
7803625	SiH4	Silane	InChI=1S/H4Si/h1H4	BLRPTPMANUNPDV-UHFFFAOYSA-N	[SiH4]		Monosilane; Silane; Silicane; Silicon hydride; Silicon hydride (SiH4); Silicon tetrahydride
7803625	SiH4+	Silane cation	InChI=1S/H4Si/h1H4/q+1	WHUUBEIUVZVOTM-UHFFFAOYSA-N	[SiH4+]
165962107	SiH5+	Silane, protonated	InChI=1S/H5Si/h1H5/q+1		[SiH5+]
7723140	P-	Phosphorus atom anion	InChI=1S/P/q-1	FFZANLXOAFSSGC-UHFFFAOYSA-N	[P-]	P-
7723140	P	Phosphorus atom	InChI=1S/P	OAICVXFJPJFONN-UHFFFAOYSA-N	[P]	P	Phosphorous; Phosphorus; Phosphorus, red; Phosphorus-30; Red phosphorus; White phosphorus
7723140	P+	Phosphorus atom cation	InChI=1S/P/q+1	FTFMSLKBXSATDG-UHFFFAOYSA-N	[P+]	P+
13967141	PH-	phosphorus monohydride anion	InChI=1S/HP/h1H/q-1	VRUBMEWWHJUCBX-UHFFFAOYSA-N	[PH-]
13967141	PH	phosphorus monohydride	InChI=1S/HP/h1H	BHEPBYXIRTUNPN-UHFFFAOYSA-N	[PH]		Phosphinidene
13967141	PH+	phosphorus monohydride cation	InChI=1S/HP/h1H/q+1	OVTNABWEZDTKEN-UHFFFAOYSA-N	[PH+]
13765430	PH2-	Phosphino anion	InChI=1S/H2P/h1H2/q-1	JZWFHNVJSWEXLH-UHFFFAOYSA-N	[PH2-]
13765430	PH2	Phosphino radical	InChI=1S/H2P/h1H2	FVZVCSNXTFCBQU-UHFFFAOYSA-N	[PH2]		Phosphino; Phosphino radical
13765430	PH2+	Phosphino cation	InChI=1S/H2P/h1H2/q+1	UCEAQYMTODNVSU-UHFFFAOYSA-N	[PH2+]
7803512	PH3	Phosphine	InChI=1S/H3P/h1H3	XYFCBTPGUUZFHI-UHFFFAOYSA-N	P		Celphos; Delicia; Detia; Detia gas ex-B; Fosforowodor; Gas-ex-B; Hydrogen phosphide; Phosphene; Phosphine; Phosphorus hydride; Phosphorus trihydride; Phosphorwasserstoff; phosphane
7803512	PH3+	Phosphine cation	InChI=1S/H3P/h1H3/q+1	UTXZMINRCDLQKG-UHFFFAOYSA-N	[PH3+]
16749136	PH4	Phosphoranyl radical	InChI=1S/H4P/h1H4		[PH4]
16749136	PH4+	phosphonium cation	InChI=1S/H3P/h1H3/p+1	XYFCBTPGUUZFHI-UHFFFAOYSA-O	[PH4+]
7704349	S-	Sulfur atom anion	InChI=1S/S/q-1	ARNUDCKQSCEIEX-UHFFFAOYSA-N	[S-]	S-
7704349	S	Sulfur atom	InChI=1S/S	NINIDFKCEFEMDL-UHFFFAOYSA-N	[S]	S	Atomic sulfur; Brimstone; Flowers of sulfur; Sulfur; Sulfur atom
7704349	S+	Sulfur atom cation	InChI=1S/S/q+1	NKARKLBRYYSBBM-UHFFFAOYSA-N	[S+]	S+
13780239	DS	Mercapto-d	InChI=1S/HS/h1H/i1D	PXQLVRUNWNTZOS-MICDWDOJSA-N	[S][2H]		Mercapto-D
13940211	HS-	mercapto anion	InChI=1S/H2S/h1H2/p-1	RWSOTUBLDIXVET-UHFFFAOYSA-M	[SH-]		HS anion
13940211	HS	Mercapto radical	InChI=1S/HS/h1H	PXQLVRUNWNTZOS-UHFFFAOYSA-N	[SH]		Mercapto; Mercapto radical; Sulfanyl; λ1-Sulfane
13940211	HS+	sulfur monohydride cation	InChI=1S/HS/h1H/q+1	GSVBMMRCPHEJKN-UHFFFAOYSA-N	[SH+]
7783064	H2S-	Hydrogen sulfide anion	InChI=1S/H2S/h1H2/q-1	ORXYGCWTUSCTLH-UHFFFAOYSA-N	[SH2-]
7783064	H2S-	Hydrogen sulfide anion	InChI=1S/H2S/h1H2/q-1	ORXYGCWTUSCTLH-UHFFFAOYSA-N	[SH2-]
7783064	H2S	Hydrogen sulfide	InChI=1S/H2S/h1H2	RWSOTUBLDIXVET-UHFFFAOYSA-N	S		Acide sulfhydrique; Dihydrogen monosulfide; Dihydrogen sulfide; Hepatic gas; Hydrogen sulfide; Hydrogen sulfide (H2S); Hydrogen sulfuric acid; Hydrogene sulfure; Hydrogen-sulphide-; Hydrosulfuric acid; Idrogeno solforato; Schwefelwasserstoff; Siarkowodor; Stink damp; Sulfur hydride; Sulfureted hydrogen; Sulfuretted hydrogen; Zwavelwaterstof; Sulfane
7783064	H2S+	Hydrogen sulfide cation	InChI=1S/H2S/h1H2/q+1	PZLIRJTVVIBARZ-UHFFFAOYSA-N	[SH2+]
13536942	D2S	Hydrogen sulfide-d2	InChI=1S/H2S/h1H2/i/hD2	RWSOTUBLDIXVET-ZSJDYOACSA-N	S([2H])[2H]		Hydrogen sulfide-D2
18155210	H3S+	Sulfonium cation	InChI=1S/H2S/h1H2/p+1	RWSOTUBLDIXVET-UHFFFAOYSA-O	[SH3+]		Sulfonium
22537151	Cl-	Chlorine atom anion	InChI=1S/ClH/h1H/p-1	VEXZGXHMUGYJMC-UHFFFAOYSA-M	[Cl-]	Cl-	chloride
22537151	Cl	Chlorine atom	InChI=1S/Cl	ZAMOUSCENKQFHK-UHFFFAOYSA-N	[Cl]	Cl	Chlorine atom; Chlorine radical; chlorine
22537151	Cl+	Chlorine atom cation	InChI=1S/Cl/q+1	KVPIFZRDXDYGBA-UHFFFAOYSA-N	[Cl+]	Cl+
7698057	DCl	Hydrochloric acid-d	InChI=1S/ClH/h1H/i/hD	VEXZGXHMUGYJMC-DYCDLGHISA-N	[2HCl]		Hydrochloric acid-d
7647010	HCl-	hydrogen chloride anion	InChI=1S/ClH/h1H/q-1	XTUZKALZYULBAJ-UHFFFAOYSA-N	[ClH-]
7647010	HCl	Hydrogen chloride	InChI=1S/ClH/h1H	VEXZGXHMUGYJMC-UHFFFAOYSA-N	Cl		Acide chlorhydrique; Acido cloridrico; Basilin; Chlorohydric acid; Chlorwasserstoff; Hydrochloric Acid; Hydrochloric acid gas; Hydrochloride; Hydrogen chloride; Muriatic acid; NA 1789
7647010	HCl+	hydrogen chloride cation	InChI=1S/ClH/h1H/q+1	BMELVZUCMXKZLN-UHFFFAOYSA-N	[ClH+]
42348414	H2Cl+	dihydrogen monochloride cation	InChI=1S/ClH2/h1H2/q+1	IGJWHVUMEJASKV-UHFFFAOYSA-N	[ClH2+]		chloronium
7440371	Ar-	Argon atom anion	InChI=1S/Ar/q-1	WVEDPOPMYOEMCB-UHFFFAOYSA-N	[Ar-]	Ar-
7440371	Ar	Argon atom	InChI=1S/Ar	XKRFYHLGVUSROY-UHFFFAOYSA-N	[Ar]	Ar	Argon
7440371	Ar+	Argon atom cation	InChI=1S/Ar/q+1	XJVBHCCEUWWHMI-UHFFFAOYSA-N	[Ar+]	Ar+
12254681	ArH+	Argon hydride cation	InChI=1S/ArH/h1H/q+1	TVQSUVFYDVJWLI-UHFFFAOYSA-N	[ArH+]		argonium; argon, protonated
13939156	H2Ar	H2 Ar dimer	InChI=1S/ArH2/	XKRFYHLGVUSROY-UHFFFAOYSA-N	[ArH2]
7440097	K-	Potassium atom anion	InChI=1S/K/q-1	UWWOIRWVTCLRBA-UHFFFAOYSA-N	[K-]	K-
7440097	K	Potassium atom	InChI=1S/K	ZLMJMSJWJFRBEC-UHFFFAOYSA-N	[K]	K
7440097	K+	Potassium atom cation	InChI=1S/K/q+1	NPYPAHLBTDXSSS-UHFFFAOYSA-N	[K+]	K+
7693267	KH	Potassium hydride	InChI=1S/K.H	NTTOTNSKUYCDAV-UHFFFAOYSA-N	[KH]
7693267	KH+	Potassium hydrogen cation	InChI=1S/K.H/q+1;	IVAWLQKTSHESMG-UHFFFAOYSA-N	[KH+]
7440702	Ca-	Calcium atom anion	InChI=1S/Ca/q-1	XKKBEAHLYVJDCI-UHFFFAOYSA-N	[Ca-]	Ca-
7440702	Ca	Calcium atom	InChI=1S/Ca	OYPRJOBELJOOCE-UHFFFAOYSA-N	[Ca]	Ca
7440702	Ca+	Calcium atom cation	InChI=1S/Ca/q+1	JDMNMMCDWTVNSP-UHFFFAOYSA-N	[Ca+]	Ca+
14452756	CaH	Calcium monohydride	InChI=1S/Ca.H	PKHCKQOIOXDRJH-UHFFFAOYSA-N	[CaH]
14452756	CaH+	Calcium monohydride cation	InChI=1S/Ca.H/q+1;	RCNSIXLSPLIYSS-UHFFFAOYSA-N	[CaH+]
7789788	CaH2	Calcium Hydride	InChI=1S/Ca.2H	FAQLAUHZSGTTLN-UHFFFAOYSA-N	[CaH2]		Calcium dihydride; calcium hydride
7789788	CaH2	Calcium Hydride	InChI=1S/Ca.2H	FAQLAUHZSGTTLN-UHFFFAOYSA-N	[CaH2]		Calcium dihydride; calcium hydride
7440202	Sc	Scandium atom	InChI=1S/Sc	SIXSYDAISGFNSX-UHFFFAOYSA-N	[Sc]	Sc
7440202	Sc+	Scandium cation	InChI=1S/Sc/q+1	MHBCCBGBYYHDBC-UHFFFAOYSA-N	[Sc+]	Sc+
33486021	ScH	Scandium monohydride	InChI=1S/Sc.H	ZTOCXCPDHKWLBM-UHFFFAOYSA-N	[ScH]
33486021	ScH+	Scandium monohydride cation	InChI=1S/Sc.H/q+1;	PMPBZPSFNVZWMY-UHFFFAOYSA-N	[ScH+]
43238079	ScH3	Scandium trihydride	InChI=1S/Sc.3H	NTLPNEDDYLQQDI-UHFFFAOYSA-N	[ScH3]		Scandium hydride
43238079	ScH3	Scandium trihydride	InChI=1S/Sc.3H	NTLPNEDDYLQQDI-UHFFFAOYSA-N	[ScH3]		Scandium hydride
13776993	TiH	Titanium monohydride	InChI=1S/Ti.H	FUMHXHODRLFENL-UHFFFAOYSA-N	[TiH]
7440326	Ti-	Titanium atom anion	InChI=1S/Ti/q-1	GYWHMGQAAYKUQS-UHFFFAOYSA-N	[Ti-]	Ti-
7440326	Ti	Titanium atom	InChI=1S/Ti	RTAQQCXQSZGOHL-UHFFFAOYSA-N	[Ti]	Ti
7440326	Ti+	Titanium atom cation	InChI=1S/Ti/q+1	NWCHXEGXZIUQJS-UHFFFAOYSA-N	[Ti+]	Ti+
7440622	V	Vanadium atom	InChI=1S/V	LEONUFNNVUYDNQ-UHFFFAOYSA-N	[V]	V
7440622	V+	Vanadium atom cation	InChI=1S/V/q+1		[V+]	V+
7440473	Cr	Chromium atom	InChI=1S/Cr		[Cr]	Cr
13966795	CrH	Chromium hydride	InChI=1S/Cr.H		[CrH]		Chromium monohydride
13966795	CrH+	Chromium hydride cation	InChI=1S/Cr.H/q+1;		[CrH+]		Protonated Chromium
7439965	Mn	Manganese atom	InChI=1S/Mn		[Mn]	Mn
7439896	Fe	Iron atom	InChI=1S/Fe	XEEYBQQBJWHFJM-UHFFFAOYSA-N	[Fe]	Fe
7440484	Co	Cobalt atom	InChI=1S/Co		[Co]	Co
7440020	Ni	Nickel atom	InChI=1S/Ni		[Ni]	Ni
7440508	Cu-	Copper atom anion	InChI=1S/Cu/q-1	RKADKOKIYLNVPJ-UHFFFAOYSA-N	[Cu-]	Cu-
7440508	Cu	Copper atom	InChI=1S/Cu	RYGMFSIKBFXOCR-UHFFFAOYSA-N	[Cu]	Cu
7440508	Cu+	Copper atom cation	InChI=1S/Cu/q+1	VMQMZMRVKUZKQL-UHFFFAOYSA-N	[Cu+]	Cu+
13517005	CuH	Copper monohydride	InChI=1S/Cu.H	JJFLDSOAQUJVBF-UHFFFAOYSA-N	[CuH]
7440666	Zn-	Zinc atom anion	InChI=1S/Zn/q-1	UFLZNUWLGDSEQA-UHFFFAOYSA-N	[Zn-]	Zn-
7440666	Zn	Zinc atom	InChI=1S/Zn	HCHKCACWOHOZIP-UHFFFAOYSA-N	[Zn]	Zn
7440666	Zn+	Zinc atom cation	InChI=1S/Zn/q+1	PLSXAKJQEDOMBH-UHFFFAOYSA-N	[Zn+]	Zn+
13981878	ZnH	Zinc monohydride	InChI=1S/Zn.H	FLVYKYVLYPYTAY-UHFFFAOYSA-N	[ZnH]
13981878	ZnH+	Zinc, protonated	InChI=1S/Zn.H/q+1;		[ZnH+]
14018827	ZnH2	Zinc hydride	InChI=1S/Zn.2H	ZULTYUIALNTCSA-UHFFFAOYSA-N	[ZnH2]
14018827	ZnH2	Zinc hydride	InChI=1S/Zn.2H	ZULTYUIALNTCSA-UHFFFAOYSA-N	[ZnH2]
7440553	Ga-	Gallium atom anion	InChI=1S/Ga/q-1	CWZISXLENQJSCT-UHFFFAOYSA-N	[Ga-]	Ga-
7440553	Ga	Gallium atom	InChI=1S/Ga	GYHNNYVSQQEPJS-UHFFFAOYSA-N	[Ga]	Ga
7440553	Ga+	Gallium atom cation	InChI=1S/Ga/q+1	IFQPNYVMPDHHHH-UHFFFAOYSA-N	[Ga+]	Ga+
13572924	GaH	Gallium monohydride	InChI=1S/Ga.H	XBIFJPLECUHRFG-UHFFFAOYSA-N	[GaH]
13572924	GaH+	Gallium monohydride cation	InChI=1S/Ga.H/q+1;	PIBWUQQSMYRAAW-UHFFFAOYSA-N	[GaH+]
13572935	GaH3	Gallium trihydride	InChI=1S/Ga.3H	PHMDYZQXPPOZDG-UHFFFAOYSA-N	[GaH3]
7440564	Ge-	Germanium anion	InChI=1S/Ge/q-1	HAIDGNUGORKGFS-UHFFFAOYSA-N	[Ge-]	Ge-
7440564	Ge	Germanium atom	InChI=1S/Ge	GNPVGFCGXDBREM-UHFFFAOYSA-N	[Ge]	Ge
7440564	Ge+	Germanium cation	InChI=1S/Ge/q+1	GJURCGDBQJCAEQ-UHFFFAOYSA-N	[Ge+]	Ge+
13572991	GeH	germylidene	InChI=1S/GeH/h1H	ROUHNNRKLNITEM-UHFFFAOYSA-N	[GeH]
13572991	GeH+	Germaniun monohyrdide cation	InChI=1S/GeH/h1H/q+1	VBLCRKLUGXNPLU-UHFFFAOYSA-N	[GeH+]
24968556	GeH2-	germylene anion	InChI=1S/GeH2/h1H2/q-1	JAQAYQUCMJAWLC-UHFFFAOYSA-N	[GeH2-]
24968556	GeH2	germylene	InChI=1S/GeH2/h1H2	MWRNXFLKMVJUFL-UHFFFAOYSA-N	[GeH2]
13765452	GeH3	Germyl radical	InChI=1S/GeH3/h1H3	WHYHZFHCWGGCOP-UHFFFAOYSA-N	[GeH3]
13765452	GeH3+	germyl cation	InChI=1S/GeH3/h1H3/q+1	VBLCRKLUGXNPLU-UHFFFAOYSA-N	[GeH3+]
7782652	GeH4	Germane	InChI=1S/GeH4/h1H4	QUZPNFFHZPRKJD-UHFFFAOYSA-N	[GeH4]
7440382	As-	Arsenic anion	InChI=1S/As/q-1	SAYILIZETGBEGT-UHFFFAOYSA-N	[As-]	As-
7440382	As	Arsenic atomic	InChI=1S/As	RQNWIZPPADIBDY-UHFFFAOYSA-N	[As]	As	Arsen
7440382	As+	Arsenic cation	InChI=1S/As/q+1	QJMDPKWWZYVKPP-UHFFFAOYSA-N	[As+]	As+
12628089	AsH	Arsenic monohydride	InChI=1S/AsH/h1H	UIESIEAPEWREMY-UHFFFAOYSA-N	[AsH]
12628089	AsH+	Arsenic monohydride cation	InChI=1S/AsH/h1H/q+1	YNRJCPSAOKLVNQ-UHFFFAOYSA-N	[AsH+]
14644452	AsH2	Arsenic dihydride	InChI=1S/AsH2/h1H2	WLQSSCFYCXIQDZ-UHFFFAOYSA-N	[AsH2]
14644452	AsH2+	Arsenic dihydride cation	InChI=1S/AsH2/h1H2/q+1	SVZSKDKRFCIVHU-UHFFFAOYSA-N	[AsH2+]
53250401	AsH4+	Arsonium	InChI=1S/AsH4/h1H4/q+1		[AsH4+]
7784421	AsH3	Arsine	InChI=1S/AsH3/h1H3	RBFQJDQYXXHULB-UHFFFAOYSA-N	[AsH3]		Arsenic trihydride; Arsenic hydride; Arsenous hydride; Hydrogen arsenide; arsine
7784421	AsH3+	Arsine cation	InChI=1S/AsH3/h1H3/q+1	LTKWZIUEGOOERX-UHFFFAOYSA-N	[AsH3+]
7782492	Se-	Selenium atom anion	InChI=1S/Se/q-1	SUHKCRJAAHZROE-UHFFFAOYSA-N	[Se-]	Se-
7782492	Se	Selenium atom	InChI=1S/Se	BUGBHKTXTAQXES-UHFFFAOYSA-N	[Se]	Se	Selenium
7782492	Se+	Selenium atom cation	InChI=1S/Se/q+1	XEBNFCTZPFEGJZ-UHFFFAOYSA-N	[Se+]	Se+
13940222	HSe-	selenium monohydride anion	InChI=1S/H2Se/h1H2/p-1	SPVXKVOXSXTJOY-UHFFFAOYSA-M	[SeH-]
13940222	HSe	Selenium monohydride	InChI=1S/HSe/h1H	VUGWMQXJZSOYNI-UHFFFAOYSA-N	[SeH]
13940222	HSe+	selenium monohydride cation	InChI=1S/HSe/h1H/q+1	LVYQWKJDVCSMKZ-UHFFFAOYSA-N	[SeH+]
7783075	H2Se	Hydrogen selenide	InChI=1S/H2Se/h1H2	SPVXKVOXSXTJOY-UHFFFAOYSA-N	[SeH2]		selane
7783075	H2Se+	Hydrogen selenide cation	InChI=1S/H2Se/h1H2/q+1	OYCCEJDXRNNGFC-UHFFFAOYSA-N	[SeH2+]
42423187	H3Se+	Hydrogen Selenide, protonated	InChI=1S/H2Se/h1H2/p+1	SPVXKVOXSXTJOY-UHFFFAOYSA-O	[SeH3+]		Selenonium
10097322	Br-	Bromine atom anion	InChI=1S/BrH/h1H/p-1	CPELXLSAUQHCOX-UHFFFAOYSA-M	[Br-]	Br-	bromide
10097322	Br	Bromine atom	InChI=1S/Br	WKBOTKDWSSQWDR-UHFFFAOYSA-N	[Br]	Br	bromine
10097322	Br+	Bromine atom cation	InChI=1S/Br/q+1	SOUPRKFYMHZDHZ-UHFFFAOYSA-N	[Br+]	Br+
10035106	HBr-	hydrogen bromide anion	InChI=1S/BrH/h1H/q-1	VNDNKBDGWXYLAJ-UHFFFAOYSA-N	[BrH-]
10035106	HBr	hydrogen bromide	InChI=1S/BrH/h1H	CPELXLSAUQHCOX-UHFFFAOYSA-N	Br		Bromwasserstoff; Hydrobromic acid; hydrogen bromide
10035106	HBr+	hydrogen bromide cation	InChI=1S/BrH/h1H	CPELXLSAUQHCOX-UHFFFAOYSA-N	[BrH+]
36658545	H2Br+	protonated hydrogen bromide	InChI=1S/BrH2/h1H2/q+1	WNNBBVLEFUBNE-UHFFFAOYSA-N	[BrH2+]
7439909	Kr	Krypton atom	InChI=1S/Kr	DNNSSWSSYDEUBZ-UHFFFAOYSA-N	[Kr]	Kr	Krypton
7439909	Kr+	Krypton cation	InChI=1S/Kr/q+1		[Kr+]	Kr+
75775529	KrH+	Protonated Krypton	InChI=1S/KrH/h1H/q+1	YDDYRYFCLMHJOO-UHFFFAOYSA-N	[KrH+]		Krypton hydrogen cation
7440315	Sn	Tin atom	InChI=1S/Sn	ATJFFYVFTNAWJD-UHFFFAOYSA-N	[Sn]	Sn
7440315	Sn+	Tin cation	InChI=1S/Sn/q+1		[Sn+]	Sn+
2406522	SnH4	Stannane	InChI=1S/Sn.4H		[SnH4]		Tin tetrahydride
7440360	Sb	Antimony atom	InChI=1S/Sb	WATWJIUSRGPENY-UHFFFAOYSA-N	[Sb]	Sb	Stibnum
13940357	SbH	Antimony monohydride	InChI=1S/Sb.H		[SbH]		Stibylene
7803523	SbH3	Stibine	InChI=1S/Sb.3H		[SbH3]		Antimony trihydride; Hydrogen antimonide
13494809	Te	Tellurium atom	InChI=1S/Te	PORWMNRCUJJQNO-UHFFFAOYSA-N	[Te]	Te
13494809	Te+	Tellurium atom cation	InChI=1S/Te/q+1		[Te+]	Te+
13940368	TeH	Telluryl radical	InChI=1S/HTe/h1H		[TeH]		Tellurium monohydride
7783097	H2Te	Hydrogen Telluride	InChI=1S/H2Te/h1H2	VTLHPSMQDDEFRU-UHFFFAOYSA-N	Te		dihydrogen telluride
14362448	I-	Iodine atom anion	InChI=1S/HI/h1H/p-1	XMBWDFGMSWQBCA-UHFFFAOYSA-M	[I-]	I-	Iodide
14362448	I	Iodine atom	InChI=1S/I	ZCYVEMRRCGMTRW-UHFFFAOYSA-N	[I]	I
14362448	I+	Iodine atom cation	InChI=1S/I/q+1	OCVXZQOKBHXGRU-UHFFFAOYSA-N	[I+]	I+
10034852	HI	Hydrogen iodide	InChI=1S/HI/h1H	XMBWDFGMSWQBCA-UHFFFAOYSA-N	I		Hydriodic acid; Hydroiodic acid; hydrogen iodide
10034852	HI+	Hydrogen iodide cation	InChI=1S/HI/h1H/q+1		[IH+]
312602429	H2I+	Iodonium	InChI=1S/H2I/h1H2/q+1		[IH2+]
7440633	Xe	Xenon atom	InChI=1S/Xe	FHNFHKCVQCLJFQ-UHFFFAOYSA-N	[Xe]	Xe
37276918	XeH+	Xenon, protonated	InChI=1S/XeH/h1H/q+1		[XeH+]
14452596	Li2-	lithium diatomic anion	InChI=1S/2Li/q;-1	DCXJJSWYYIPAAD-UHFFFAOYSA-N	[Li]=[Li-]
14452596	Li2	Lithium diatomic	InChI=1S/2Li	SMBQBQBNOXIFSF-UHFFFAOYSA-N	[Li][Li]		Lithium; Lithium dimer; dilithium
14452596	Li2+	lithium diatomic cation	InChI=1S/2Li/q;+1	MUROIUMQESCVOM-UHFFFAOYSA-N	[Li][Li+]
14452609	Be2-	Beryllium diatomic anion	InChI=1S/2Be/q;-1	MPNVSFJMJLUABI-UHFFFAOYSA-N	[Be-]#[Be]
14452609	Be2	Beryllium diatomic	InChI=1S/2Be	SQOQGLGTQLQRCC-UHFFFAOYSA-N	[Be][Be]		Beryllium; diberyllium
14452609	Be2+	Beryllium diatomic cation	InChI=1S/2Be/q;+1	OHDADTLFLQMTIK-UHFFFAOYSA-N	[Be+][Be]
9000365	LiBe	Lithium Beryllium	InChI=1S/Be.Li	OXCFQWSYBCETRX-UHFFFAOYSA-N	[Li][Be]
12523567	LiB	Lithium boride	InChI=1S/B.Li	PPTSBERGOGHCHC-UHFFFAOYSA-N	[Li][B]		Lithium monoboride
14452610	B2-	Boron diatomic anion	InChI=1S/B2/c1-2/q-1	PZMBRWKYOAZOLI-UHFFFAOYSA-N	[B-]#B
14452610	B2	Boron diatomic	InChI=1S/B2/c1-2	ZOCHARZZJNPSEU-UHFFFAOYSA-N	[B]=[B]		boron; boron dimer; diboron
14452610	B2+	Boron diatomic cation	InChI=1S/B2/c1-2/q+1	NWEAICZXKBZCHB-UHFFFAOYSA-N	[B+]=[B]
57679637	BeB	Beryllium monoboride	InChI=1S/B.Be	IIAHSYIVJGROSB-UHFFFAOYSA-N	[Be][B]		Beryllium boride
56125747	HBBH	Diborane(2)	InChI=1S/B2H2/c1-2/h1-2H		B=B
18099451	B2H4	Diborane(4) D2d	InChI=1S/B2H4/c1-2/h1-2H2	QSJRRLWJRLPVID-UHFFFAOYSA-N	BB
16949158	LiBH4	Lithium borohydride	InChI=1S/BH4.Li/h1H4;/q-1;+1	UUKMSDRCXNLYOO-UHFFFAOYSA-N	[Li+].[BH4-]		lithium tetrahydroborate
9000348	HBHHBH	Diborane(4) C2V	InChI=1S/B2H4/c1-3-2-4-1/h1-2H	DMJZZSLVPSMWCS-UHFFFAOYSA-N	B.B
19287457	B2H6	Diborane	InChI=1S/B2H6/c1-3-2-4-1/h1-2H2	KLDBIFITUCWVCC-UHFFFAOYSA-N	[BH2]1[H][BH2][H]1		Boron hydride; Diboron hexahydride; Boroethane
19287457	B2H6+	Diborane cation	inchi
57788939	LiC	Lithium Carbide	InChI=1S/C.Li	YZSKZXUDGLALTQ-UHFFFAOYSA-N	[Li][C]
57788940	BeC	Beryllium Carbide	InChI=1S/C.Be	XBJYWZKBHDUHGE-UHFFFAOYSA-N	[Be][C]
12011540	BC-	boron monocarbide anion	InChI=1S/CB/c1-2/q-1	PTCGYRYBWREJNW-UHFFFAOYSA-N	B#[C-]		Boron carbide
12011540	BC	boron monocarbide	InChI=1S/CB/c1-2	UPGPUHVYNXOPJN-UHFFFAOYSA-N	B#[C]		Boron carbide
12011540	BC+	boron monocarbide cation	InChI=1S/CB/c1-2/q+1	ONHLBSUXAJZTBR-UHFFFAOYSA-N	B#[C+]		Boron carbide
12070154	C2-	carbon diatomic anion	InChI=1S/C2/c1-2/q-1	XHWLRFQJZNQFGO-UHFFFAOYSA-N	[C-]=[C]
12070154	C2	Carbon diatomic	InChI=1S/C2/c1-2	LBVWYGNGGJURHQ-UHFFFAOYSA-N	[C]#[C]		Carbon (C2); Carbon dimer; Dicarbon
12070154	C2+	carbon diatomic cation	InChI=1S/C2/c1-2/q+1	ADIRGMFQWJHVBM-UHFFFAOYSA-N	[C+]#[C]
2122487	C2H-	Ethynyl anion	InChI=1S/C2H/c1-2/h1H/q-1	BLRXYTIIKIPJQL-UHFFFAOYSA-N	[C-]#C
2122487	C2H	Ethynyl radical	InChI=1S/C2H/c1-2/h1H	XEHVFKKSDRMODV-UHFFFAOYSA-N	[C]#C		Ethynyl; Ethynyl radical
2122487	C2H	Ethynyl radical	InChI=1S/C2H/c1-2/h1H	XEHVFKKSDRMODV-UHFFFAOYSA-N	[C]#C		Ethynyl; Ethynyl radical
2122487	C2H+	Ethynyl cation	InChI=1S/C2H/c1-2/h1H/q+1	UAYUAPRVBCKABF-UHFFFAOYSA-N	[C+]#C
2122487	C2H+	Ethynyl cation	InChI=1S/C2H/c1-2/h1H/q+1	UAYUAPRVBCKABF-UHFFFAOYSA-N	[C+]#C
2143693	H2CC-	vinylidene anion	InChI=1S/C2H2/c1-2/h1H2/q-1		[CH2][C-]
2143693	CCH2	vinylidene	InChI=1S/C2H2/c1-2/h1H2	SNVLJLYUUXKWOJ-UHFFFAOYSA-N	[C]=C
74862	HCCH-	acetylene anion	InChI=1S/C2H2/c1-2/h1-2H/q-1		[CH][CH-]
74862	HCCH-	acetylene anion	InChI=1S/C2H2/c1-2/h1-2H/q-1		[CH][CH-]
74862	C2H2	Acetylene	InChI=1S/C2H2/c1-2/h1-2H	HSFWRNGVRCDJHI-UHFFFAOYSA-N	C#C		Acetylen; Acetylene; Ethine; Ethyne; Narcylen; Vinylene
74862	C2H2+	acetylene cation	InChI=1S/C2H2/c1-2/h1-2H/q+1	GWUDYHMQOUXMQT-UHFFFAOYSA-N	[CH]=[CH+]
74862	C2H2+	acetylene cation	InChI=1S/C2H2/c1-2/h1-2H/q+1	GWUDYHMQOUXMQT-UHFFFAOYSA-N	[CH]=[CH+]
2669898	C2H3-	vinyl anion	InChI=1S/C2H3/c1-2/h1H,2H2/q-1	IEARPTNIYZTWOZ-UHFFFAOYSA-N	[CH-][CH2]
2669898	C2H3	vinyl	InChI=1S/C2H3/c1-2/h1H,2H2	ORGHESHFQPYLAO-UHFFFAOYSA-N	[CH]=C		Vinyl; Vinyl radical
2669898	C2H3+	vinyl cation	InChI=1S/C2H3/c1-2/h1H,2H2/q+1	QLLSNXSJBAXPLZ-UHFFFAOYSA-N	[CH+]=C
2669898	C2H3+	vinyl cation	InChI=1S/C2H3/c1-2/h1H,2H2/q+1	QLLSNXSJBAXPLZ-UHFFFAOYSA-N	[CH+]=C
917544	CH3Li	methyl lithium	InChI=1S/CH3.Li/h1H3;	DVSDBMFJEQPWNO-UHFFFAOYSA-N	[Li]C
56125758	CH2BH	methyleneborane	InChI=1S/CH3B/c1-2/h2H,1H2	DJWFTFKVJARRDX-UHFFFAOYSA-N	C=B
4218502	CH3CH	methylmethylene	InChI=1S/C2H4/c1-2/h1H,2H3	UUFQTNFCRMXOAE-UHFFFAOYSA-N	[CH]C
74851	C2H4-	Ethylene anion	InChI=1S/C2H4/c1-2/h1-2H2/q-1	BZBBQTIJNPYMER-UHFFFAOYSA-N	[CH2][CH2-]
74851	C2H4-	Ethylene anion	InChI=1S/C2H4/c1-2/h1-2H2/q-1	BZBBQTIJNPYMER-UHFFFAOYSA-N	[CH2][CH2-]
74851	C2H4	Ethylene	InChI=1S/C2H4/c1-2/h1-2H2	VGGSQFUCUMXWEO-UHFFFAOYSA-N	C=C		Acetene; Athylen; Bicarburretted hydrogen; Elayl; Ethene; Ethylene; Liquid ethyene; Olefiant gas
74851	C2H4+	Ethylene cation	InChI=1S/C2H4/c1-2/h1-2H2/q+1	RHAJFDHSLMUKSD-UHFFFAOYSA-N	[CH2][CH2+]
74851	C2H4+	Ethylene cation	InChI=1S/C2H4/c1-2/h1-2H2/q+1	RHAJFDHSLMUKSD-UHFFFAOYSA-N	[CH2][CH2+]
2025561	C2H5-	Ethyl anion	InChI=1S/C2H5/c1-2/h1H2,2H3/q-1	KMMMKPYXRLFMSO-UHFFFAOYSA-N	C[CH2-]
2025561	C2H5	Ethyl radical	InChI=1S/C2H5/c1-2/h1H2,2H3	QUPDWYMUPZLYJZ-UHFFFAOYSA-N	[CH2]C		Ethyl radical; ethyl
2025561	C2H5+	Ethyl cation	InChI=1S/C2H5/c1-2-3-1/h1-2H2/q+1	YPFHUCDBTFBXTJ-UHFFFAOYSA-N	[CH2+]C
2025561	C2H5+	Ethyl cation	InChI=1S/C2H5/c1-2-3-1/h1-2H2/q+1	YPFHUCDBTFBXTJ-UHFFFAOYSA-N	[CH2+]C
12538964	CH3BH2	methylborane	InChI=1S/CH5B/c1-2/h2H2,1H3	PLFLRQISROSEIJ-UHFFFAOYSA-N	CB		borane, methyl-
74840	C2H6	Ethane	InChI=1S/C2H6/c1-2/h1-2H3	OTMSDBZUPAUEDD-UHFFFAOYSA-N	CC		Bimethyl; Dimethyl; Ethane; Ethyl hydride; Methylmethane
74840	C2H6	Ethane	InChI=1S/C2H6/c1-2/h1-2H3	OTMSDBZUPAUEDD-UHFFFAOYSA-N	CC		Bimethyl; Dimethyl; Ethane; Ethyl hydride; Methylmethane
74840	C2H6+	ethane cation	InChI=1S/C2H6/c1-2/h1-2H3/q+1	DDZSVZNUVGBGGU-UHFFFAOYSA-N	C[CH3+]
74840	C2H6+	ethane cation	InChI=1S/C2H6/c1-2/h1-2H3/q+1	DDZSVZNUVGBGGU-UHFFFAOYSA-N	C[CH3+]
74840	C2H6+	ethane cation	InChI=1S/C2H6/c1-2/h1-2H3/q+1	DDZSVZNUVGBGGU-UHFFFAOYSA-N	C[CH3+]
9000381	C2H7+	Ethane, protonated	InChI=1S/C2H7/c1-3-2/h1-2H3/q+1	UQJIDEGGAKZKSY-UHFFFAOYSA-N	C.C		ethanium cation
9000381	C2H7+	Ethane, protonated	InChI=1S/C2H7/c1-3-2/h1-2H3/q+1	UQJIDEGGAKZKSY-UHFFFAOYSA-N	NULL		ethanium cation
7727379	N2-	nitrogen diatomic anion	InChI=1S/N2/c1-2/q-1	WBONKFSJBYZDJN-UHFFFAOYSA-N	[N-]=[N]
7727379	N2	Nitrogen diatomic	InChI=1S/N2/c1-2	IJGRMHOSHXDMSA-UHFFFAOYSA-N	N#N		Diatomic nitrogen; Dinitrogen; Molecular nitrogen; Nitrogen; Nitrogen gas; Nitrogen-14
7727379	N2+	diatomic nitrogen cation	InChI=1S/N2/c1-2/q+1	OCLMUTJUZGFVFC-UHFFFAOYSA-N	[N+]#N
10043115	BN-	boron nitride anion	InChI=1S/BN/c1-2/q-1	IWPZHCBXSKNBIX-UHFFFAOYSA-N	[B]=[N-]
10043115	BN	boron nitride	InChI=1S/BN/c1-2	PZNSFCLAULLKQX-UHFFFAOYSA-N	B#N
10043115	BN+	boron nitride cation	InChI=1S/BN/c1-2/q+1	WWQSUNDBMCMSCM-UHFFFAOYSA-N	[B+]=[N]
37279111	BeN-	Beryllium mononitride anion	InChI=1S/Be.N/q;-1	DNELMSQECYMCRT-UHFFFAOYSA-N	[Be]=[N-]
37279111	BeN	Beryllium mononitride	InChI=1S/Be.N	APEPCQZGRMUTTC-UHFFFAOYSA-N	[Be]=[N]
37279111	BeN+	Beryllium mononitride cation	InChI=1S/Be.N/q+1;	SDMZGJPWTZTLFF-UHFFFAOYSA-N	[Be+][N]
32746319	LiN	Lithium Nitride	InChI=1S/Li.N	GRQJZSJOACLQOV-UHFFFAOYSA-N	[Li][N]
32746319	LiN+	Lithium Nitride cation	InChI=1S/Li.N/q+1;	SQXACIWGXCWAJG-UHFFFAOYSA-N	[Li+][N]
2074875	CN-	cyanide anion	InChI=1S/CN/c1-2/q-1	XFXPMWWXUTWYJX-UHFFFAOYSA-N	[C-]#N		Cyanide
2074875	CN	Cyano radical	InChI=1S/CN/c1-2	JEVCWSUVFOYBFI-UHFFFAOYSA-N	[C]#N		Cyano radical
2074875	CN+	Cyano cation	InChI=1S/CN/c1-2/q+1	NKCCODPFBDGPRJ-UHFFFAOYSA-N	[C+]#N
6914074	HNC	hydrogen isocyanide	InChI=1S/CHN/c1-2/h2H	QIUBLANJVAOHHY-UHFFFAOYSA-N	[NH+]#[C-]
6914074	HNC+	hydrogen isocyanide cation	InChI=1S/CHN/c1-2/h2H/q+1		[C]=[NH+]
74908	HCN-	Hydrogen cyanide anion	InChI=1S/CHN/c1-2/h1H/q-1	ATBDVLSINHAXGY-UHFFFAOYSA-N	[CH-]=[N]
74908	HCN	Hydrogen cyanide	InChI=1S/CHN/c1-2/h1H	LELOWRISYMNNSU-UHFFFAOYSA-N	C#N		AC; Acide cyanhydrique; Acido cianidrico; Aero liquid hcn; Aero@ Liquid HCN; Blausaeure; Blausaeure (German); Blauwzuur; Carbon hydride nitride; Carbon hydride nitride (CHN); Cyaanwaterstof; Cyanwasserstoff; Cyclon; Cyclone B; Cyjanowodor; Evercyn; Fluohydric acid gas; Formic anammonide; Formonitrile; Hydrocyanic acid; Hydrofluoric acid gas; Hydrogen cyanide; NA 1051; Prussic Acid; Prussic acid, unstabilized; Zaclondiscoids
74908	HCN+	hydrogen cyanide cation	InChI=1S/CHN/c1-2/h1H/q+1	JUQAVPCSDMFGHW-UHFFFAOYSA-N	[CH+][N]
36882130	NNH	Dinitrogen monohydride	InChI=1S/HN2/c1-2/h1H	NALBLJLOBICXRH-UHFFFAOYSA-N	N=[N]
36882130	NNH+	Dinitrogen monohydride cation	InChI=1S/N2/c1-2/p+1	IJGRMHOSHXDMSA-UHFFFAOYSA-O	[NH+]#N
40493810	HNB	hydrogen nitrogen boron	InChI=1S/BHN/c1-2/h2H	XIUTTYIRABRWRB-UHFFFAOYSA-N	[NH][B]
54980119	HCNH	methyleneazane	InChI=1S/CH2N/c1-2/h1-2H	GNMFKYYLBRTFHL-UHFFFAOYSA-N	[CH]=N
54980119	HCNH	methyleneazane	InChI=1S/CH2N/c1-2/h1-2H	GNMFKYYLBRTFHL-UHFFFAOYSA-N	[CH]=N
54980119	HCNH+	N-protonated HCN	InChI=1S/CH2N/c1-2/h1-2H/q+1	DCMJLVFIGUTGGQ-UHFFFAOYSA-N	[CH][NH+]
28647383	H2NN	Isodiazene	InChI=1S/H2N2/c1-2/h1H2/		[NH2]=[N]
28647383	H2NN	Isodiazene	InChI=1S/H2N2/c1-2/h1H2		[NH2+][N-]
15119978	HBNH	Boranimine	InChI=1S/BH2N/c1-2/h1-2H	LNLSXDSWJBUPHM-UHFFFAOYSA-N	B=N		Borane, imino-; Iminoborane
15626423	N2H2	(Z)-Diazene	InChI=1S/H2N2/c1-2/h1-2H/b2-1-	RAABOESOVLLHRU-UPHRSURJSA-N	N=N		cis-diazine
15626423	N2H2	(Z)-Diazene	InChI=1S/H2N2/c1-2/h1-2H	RAABOESOVLLHRU-UHFFFAOYSA-N	N=N		cis-diazine
15626434	N2H2	(E)-diazene	InChI=1S/H2N2/c1-2/h1-2H/b2-1+	RAABOESOVLLHRU-OWOJBTEDSA-N	N=N		(E)-Diazene; E-diazine; t-diazine; diazine; trans-diazine
15626434	N2H2+	trans-diazene cation	InChI=1S/H2N2/c1-2/h1-2H/q+1	UGMYJEUXIMNOHA-UHFFFAOYSA-N	N=[NH+]		59952-06-6
7782890	LiNH2	lithium amide	InChI=1S/Li.H2N/h;1H2/q+1;-1		[Li]N		Lithamide
9000286	H2CN	Dihydrogen cyanide radical	InChI=1S/CH2N/c1-2/h1H2	PZIDJKOIMRBQLL-UHFFFAOYSA-N	C=[N]		Amidogen, methylene-; Methyleneimino radical; Methyleneamidogen
9000286	H2CN+	hydrocyanonium cation	InChI=1S/CH2N/c1-2/h1H2/q+1	MKPAEABOTWWIBE-UHFFFAOYSA-N	[CH2+][N]		protonated hydrogen cyanide; hydrocyanonium
9000317	CNH2	Aminomethylidyne radical	InChI=1S/CH2N/c1-2/h2H2	OGBYLFXCCAHRHC-UHFFFAOYSA-N	[C]N
9000317	CNH2+	N-protonated hydrogen isocyanide	InChI=1S/CH2N/c1-2/h2H2/q+1	RYMZMJIGPPIVIV-UHFFFAOYSA-N	[C]=[NH2+]
35430172	CHNH2	aminomethylene	InChI=1S/CH3N/c1-2/h1H,2H2		[CH]N		aminocarbene
35430172	CHNH2+	Aminocarbene cation	InChI=1S/CH3N/c1-2/h1H,2H2/q+1		[CH]=[NH2+]
2053294	CH2NH	Methanimine	InChI=1S/CH3N/c1-2/h2H,1H2	WDWDWGRYHDPSDS-UHFFFAOYSA-N	C=N		Methanimine; Methyleneimine
2053294	CH2NH+	Methanimine cation	InChI=1S/CH3N/c1-2/h2H,1H2/q+1		[CH2+][NH]
302012	N2H4	Hydrazine	InChI=1S/H4N2/c1-2/h1-2H2	OAKJQQAXSVQMHS-UHFFFAOYSA-N	NN		Diamide; Diamide hydrate; Diamine; Hydrazine; Hydrazine, anhydrous; Hydrazyna; Levoxine
302012	N2H4+	hydrazine cation	InChI=1S/H4N2/c1-2/h1-2H2/q+1	HWDYJVUNTFRESF-UHFFFAOYSA-N	[NH2+]N
14720355	BH2NH2	Boranamine	InChI=1S/BH4N/c1-2/h1-2H2	KKAXNAVSOBXHTE-UHFFFAOYSA-N	BN
10507296	CH2NH2+	methyleneamine cation	InChI=1S/CH4N/c1-2/h1-2H2/q+1	LEOYJZAFSUBIBE-UHFFFAOYSA-N	[CH2+]N		aminomethylium; iminomethylium
10507296	CH2NH2+	methyleneamine cation	InChI=1S/CH3N/c1-2/h2H,1H2/p+1	WDWDWGRYHDPSDS-UHFFFAOYSA-O	C=[NH2+]		aminomethylium; iminomethylium
18500328	N2H5+	protonated hydrazine	InChI=1S/H4N2/c1-2/h1-2H2/p+1	OAKJQQAXSVQMHS-UHFFFAOYSA-O	[NH3+]N
74895	CH3NH2	methyl amine	InChI=1S/CH5N/c1-2/h2H2,1H3	BAVYZALUXZFZLV-UHFFFAOYSA-N	CN		Aminomethane; Anhydrous methylamine; Carbinamine; Mercurialin; Methanamine; Methylamine; Methylaminen; Metilamine; Metyloamina; Monomethylamine
74895	CH3NH2+	methyl amine cation	InChI=1S/CH5N/c1-2/h2H2,1H3/q+1	BAVYZALUXZFZLV-UHFFFAOYSA-N	C[NH2+]
22	NH3NH3	Ammonia Dimer	InChI=1S/H6N2/c1-3-2/h1H2,2H3	AHBOEPYNTHNWIX-UHFFFAOYSA-N	N.N
22	NH3NH3	Ammonia Dimer	InChI=1S/H6N2/c1-3-2/h1H2,2H3	AHBOEPYNTHNWIX-UHFFFAOYSA-N	N.N
17000009	CH3NH3	methyl ammonium radical	InChI=1S/CH6N/c1-2/h1-2H3	LRGWETHRDQOAES-UHFFFAOYSA-N	C[NH3]
17000009	CH3NH3+	protonated methylamine	InChI=1S/CH5N/c1-2/h2H2,1H3/p+1	BAVYZALUXZFZLV-UHFFFAOYSA-O	C[NH3+]		methylammonium
13774817	BH3NH3	borane ammonia	InChI=1S/BH6N/c1-2/h1-2H3	PJYXJGDRFASJSB-UHFFFAOYSA-N	[BH3-][NH3+]
56044485	N2H7+	ammonia ammonium dimer	InChI=1S/H4N.H3N/h1H4;1H3/p+1		N.[NH4+]		protonated ammonia dimer
10102439	NO-	nitric oxide anion	InChI=1S/NO/c1-2/q-1	FZRKAZHKEDOPNN-UHFFFAOYSA-N	[N-]=O
10102439	NO	Nitric oxide	InChI=1S/NO/c1-2	MWUXSHHQAYIFBG-UHFFFAOYSA-N	[N]=O		Amidogen, oxo-; Nitric oxide; Nitrogen monoxide; Nitrogen oxide; Nitrogen oxide (NO); Nitrosyl radical
10102439	NO+	nitric oxide cation	InChI=1S/NO/c1-2/q+1	KEJOCWOXCDWNID-UHFFFAOYSA-N	[O+]#N
12142777	LiO-	lithium oxide anion	InChI=1S/Li.O/q;-1	IXZJKKSRIFXCQD-UHFFFAOYSA-N	[Li][O-]
12142777	LiO	lithium oxide	InChI=1S/Li.O	QTJOIXXDCCFVFV-UHFFFAOYSA-N	[Li][O]		Lithium oxide
12142777	LiO+	lithium oxide cation	InChI=1S/Li.O/q+1;	DTJNZKWRAPCRSU-UHFFFAOYSA-N	[Li+]=O
12505770	BO-	boron monoxide anion	InChI=1S/BO/c1-2/q-1	QDUNNVFNOBEOOX-UHFFFAOYSA-N	[B][O-]
12505770	BO	boron monoxide	InChI=1S/BO/c1-2	MOWNZPNSYMGTMD-UHFFFAOYSA-N	[B]=O		Boron monoxide; Boron oxide
12505770	BO+	boron monoxide cation	InChI=1S/BO/c1-2/q+1	OVSXTYPBDUJXGF-UHFFFAOYSA-N	[B+]=O
7782447	O2--	dioxygen dianion	InChI=1S/O2/c1-2/q-2		[O-][O-]		peroxide; Oxygen molecule dianion
7782447	O2-	oxygen diatomic anion	InChI=1S/HO2/c1-2/h1H/p-1	OUUQCZGPVNCOIJ-UHFFFAOYSA-M	[O-][O]		oxygen anion; superoxide
7782447	O2	Oxygen diatomic	InChI=1S/O2/c1-2	MYMOFIZGZYHOMD-UHFFFAOYSA-N	O=O		Dioxygen; Molecular oxygen; Oxygen; Oxygen molecule; Oxygen-16
7782447	O2+	diatomic oxygen cation	InChI=1S/O2/c1-2/q+1	KMHJKRGRIJONSV-UHFFFAOYSA-N	[O+]=O
1304569	BeO-	Beryllium monoxide anion	InChI=1S/Be.O/q;-1	VGVBRKDKZFQTIU-UHFFFAOYSA-N	[Be][O-]
1304569	BeO	beryllium oxide	InChI=1S/Be.O	LTPBRCUWZOMYOC-UHFFFAOYSA-N	[Be]=O		BeO; Beryllia; Beryllium monoxide; Beryllium oxide; Beryllium oxide (BeO); Beryllium oxide, α; Thermalox
1304569	BeO+	Beryllium monoxide cation	InChI=1S/Be.O/q;+1	JKPCLXOLRBTQAQ-UHFFFAOYSA-N	[Be+][O]
630080	CO-	carbon monoxide anion	InChI=1S/CO/c1-2/q-1	DCMZLVSOPGZIFI-UHFFFAOYSA-N	[C][O-]
630080	CO	Carbon monoxide	InChI=1S/CO/c1-2	UGFAIRIUMAVXCW-UHFFFAOYSA-N	[C]#O		Carbon monooxide; Carbon monoxide; Carbon oxide; Carbon oxide (CO); Carbone; Carbonic oxide; Carbonio; Kohlenmonoxid; Kohlenoxyd; Koolmonoxyde; Monoxide; NA 9202; Oxyde de carbone
630080	CO+	carbon monoxide cation	InChI=1S/CO/c1-2/q+1	BOJPITGAFFYFJK-UHFFFAOYSA-N	[C+]=O
1310663	LiOH	lithium hydroxide	InChI=1S/Li.H2O/h;1H2/q+1;/p-1	WMFOQBRAJBCJND-UHFFFAOYSA-M	[Li]O		Lithium Hydroxide; Lithium hydroxide hydrate; Lithium hydroxide, monohydrate
2597446	HCO-	formyl anion	InChI=1S/CHO/c1-2/h1H/q-1	CKJNUZNMWOVDFN-UHFFFAOYSA-N	[CH-]=O		formate
2597446	HCO	Formyl radical	InChI=1S/CHO/c1-2/h1H	CFHIDWOYWUOIHU-UHFFFAOYSA-N	[CH]=O		Formyl; Formyl radical
2597446	HCO+	Formyl cation	InChI=1S/CHO/c1-2/h1H/q+1	XPRMKTHGXOVKEH-UHFFFAOYSA-N	[CH+]=O
3170830	HO2-	Hydroperoxy anion	InChI=1S/H2O2/c1-2/h1-2H/p-1	MHAJPDPJQMAIIY-UHFFFAOYSA-M	O[O-]
3170830	HO2	Hydroperoxy radical	InChI=1S/HO2/c1-2/h1H	OUUQCZGPVNCOIJ-UHFFFAOYSA-N	O[O]		Hydroperoxo; Hydroperoxy radical; hydroperoxyl
3170830	HO2+	Hydroperoxy cation	InChI=1S/O2/c1-2/p+1	MYMOFIZGZYHOMD-UHFFFAOYSA-O	O=[OH+]
3170830	HO2+	Hydroperoxy cation	InChI=1S/O2/c1-2/p+1	MYMOFIZGZYHOMD-UHFFFAOYSA-O	NULL
35337598	NOH	Hydroxyimidogen	InChI=1S/HNO/c1-2/h2H	JSGZKHJWRITPII-UHFFFAOYSA-N	[N]O		Hydroxyimino; Hydroxynitrene
35337598	NOH+	O-protonated nitric oxide	InChI=1S/HNO/c1-2/h2H/q+1	MWUXSHHQAYIFBG-UHFFFAOYSA-O	[N]=[OH+]
71080927	COH	Hydroxymethylidyne	InChI=1S/CHO/c1-2/h2H		[C]O		Methylidyne, hydroxy-; isoformyl radical
71080927	COH+	Carbon Monoxide, protonated	InChI=1S/CHO/c1-2/h2H/q+1	FIRPXVMETWVPCB-UHFFFAOYSA-N	[C]=[OH+]
20611590	HBO	Boron hydride oxide	InChI=1S/BHO/c1-2/h1H	UXUFOKFTFHRQTE-UHFFFAOYSA-N	B=O		Boron hydride oxide; oxoborane
20768687	BeOH	beryllium monohydroxide	InChI=1S/Be.H2O/h;1H2/q+1;/p-1	XTIMETPJOMYPHC-UHFFFAOYSA-M	[Be]O		BeOH; Beryllium hydroxide
20768687	BeOH	beryllium monohydroxide	InChI=1S/Be.H2O/h;1H2/q+1;/p-1	XTIMETPJOMYPHC-UHFFFAOYSA-M	[Be]O		BeOH; Beryllium hydroxide
14332286	HNO-	Nitrosyl hydride anion	InChI=1S/HNO/c1-2/h1H/q-1	HSVWLSWXGPNANV-UHFFFAOYSA-N	[NH-][O]
14332286	HNO	Nitrosyl hydride	InChI=1S/HNO/c1-2/h1H	ODUCDPQEXGNKDN-UHFFFAOYSA-N	N=O		Nitrosyl hydride
14332286	HNO+	Nitrosyl hydride cation	InChI=1S/HNO/c1-2/h1H/q+1	KFRCEISWMJUBLX-UHFFFAOYSA-N	[NH+]=O
19710566	HOCH	hydroxycarbene	InChI=1S/CH2O/c1-2/h1-2H	UUOIGPDTLYBNGY-UHFFFAOYSA-N	[CH]O
19710566	HOCH	hydroxycarbene	InChI=1S/CH2O/c1-2/h1-2H	UUOIGPDTLYBNGY-UHFFFAOYSA-N	[CH]O
7722841	H2O2	Hydrogen peroxide	InChI=1S/H2O2/c1-2/h1-2H	MHAJPDPJQMAIIY-UHFFFAOYSA-N	OO		Dihydrogen dioxide; Elawox; Hydrogen dioxide; Hydrogen oxide; Hydrogen peroxide (H2O2); Perhydrol; Perossido di idrogeno; Peroxaan; Peroxyde d'hydrogene; Superoxol; T-Stuff; Waterstofperoxyde; Wasserstoffperoxid
7722841	H2O2	Hydrogen peroxide	InChI=1S/H2O2/c1-2/h1-2H	MHAJPDPJQMAIIY-UHFFFAOYSA-N	OO		Dihydrogen dioxide; Elawox; Hydrogen dioxide; Hydrogen oxide; Hydrogen peroxide (H2O2); Perhydrol; Perossido di idrogeno; Peroxaan; Peroxyde d'hydrogene; Superoxol; T-Stuff; Waterstofperoxyde; Wasserstoffperoxid
7722841	H2O2+	Hydrogen peroxide cation	InChI=1S/H2O2/c1-2/h1-2H/q+1	QLOMDXCKVWDSAC-UHFFFAOYSA-N	O[OH+]
7722841	H2O2+	Hydrogen peroxide cation	InChI=1S/H2O2/c1-2/h1-2H/q+1	QLOMDXCKVWDSAC-UHFFFAOYSA-N	O[OH+]
13408292	H2NO	nitroxide	InChI=1S/H2NO/c1-2/h1H2	YLFIGGHWWPSIEG-UHFFFAOYSA-N	[NH2]=O
50000	H2CO-	formaldehyde anion	InChI=1S/CH2O/c1-2/h1H2/q-1	RCQZCQSUQBQDGR-UHFFFAOYSA-N	C=[O-]
50000	H2CO-	formaldehyde anion	InChI=1S/CH2O/c1-2/h1H2/q-1	RCQZCQSUQBQDGR-UHFFFAOYSA-N	C=[O-]
50000	H2CO	Formaldehyde	InChI=1S/CH2O/c1-2/h1H2	WSFSSNUMVMOOMR-UHFFFAOYSA-N	C=O		Formaldehyde; Formic aldehyde; Formol; Methaldehyde; Methanal; Methyl aldehyde; Methylene glycol; Methylene oxide
50000	H2CO+	formaldehyde cation	InChI=1S/CH2O/c1-2/h1H2/q+1	SAJCHROCEMQFHF-UHFFFAOYSA-N	C=[O+]
171363090	H2OO	water oxide	InChI=1S/H2O2/c1-2/h1H2		[OH2+][O-]
2597435	CH2OH	Hydroxymethyl radical	InChI=1S/CH3O/c1-2/h2H,1H2	CBOIHMRHGLHBPB-UHFFFAOYSA-N	[CH2]O		Hydroxymethyl; Hydroxymethyl radical; Methyl radical, hydroxy-; Methyl, hydroxy-
2597435	CH2OH+	hydroxymethyl cation	InChI=1S/CH3O/c1-2/h2H,1H2/q+1	NRCYHMDIJIIHBJ-UHFFFAOYSA-N	[CH2+]O		protonated formaldehyde
2143682	CH3O-	methoxy anion	InChI=1S/CH3O/c1-2/h1H3/q-1	NBTOZLQBSIZIKS-UHFFFAOYSA-N	C[O-]		methoxide; methanolate
2143682	CH3O	Methoxy radical	InChI=1S/CH3O/c1-2/h1H3	GRVDJDISBSALJP-UHFFFAOYSA-N	C[O]		Methoxy; Methoxy radical; methoxyl
2143682	CH3O+	Methoxy cation	InChI=1S/CH3O/c1-2/h1H3/q+1	DNYFZVYVKGRENU-UHFFFAOYSA-N	C[O+]
9000359	H3O2+	hydrogen peroxide, protonated	InChI=1S/H2O2/c1-2/h1-2H/p+1	MHAJPDPJQMAIIY-UHFFFAOYSA-O	O[OH2+]
9000359	H3O2+	hydrogen peroxide, protonated	InChI=1/H2O2/c1-2/h1-2H/p+1/fH3O2/h1H/q+1	MHAJPDPJQMAIIY-CIJHYIHENA-O	O[OH2+]
7803498	NH2OH	hydroxylamine	InChI=1S/H3NO/c1-2/h2H,1H2	AVXURJPOCDRRFD-UHFFFAOYSA-N	NO		Oxammonium; hydroxylamine
7803498	NH2OH+	Hydroxylamine cation	InChI=1S/H3NO/c1-2/h2H,1H2/q+1		[NH2+]=[OH]
38544488	NH3O	Ammonia Oxide	InChI=1S/H3NO/c1-2/h1H3	GSWAOPJLTADLTN-UHFFFAOYSA-N	[NH3+][O-]		azane oxide
20712838	NH3OH+	N-protonated hydroxylamine	InChI=1S/H4NO/c1-2/h2H,1H3/q+1		[NH3+]O		Aminooxonium; Hydroxyammonium cation; Hydroxylammonium
25655838	H2OH2O	water dimer	InChI=1S/H4O2/c1-3-2/h1H,2H2	CIFBQZMBEZYWOK-UHFFFAOYSA-N	O.O		waterdimer
67561	CH3OH-	Methyl alcohol anion	InChI=1S/CH4O/c1-2/h2H,1H3/q-1	KRKKYJDHFWSRDI-UHFFFAOYSA-N	C[OH-]
67561	CH3OH-	Methyl alcohol anion	InChI=1/CH4O/c1-2/h2H,1H3/q-1	KRKKYJDHFWSRDI-UHFFFAOYNA-N	C[OH-]
67561	CH3OH-	Methyl alcohol anion	InChI=1S/CH4O/c1-2/h2H,1H3/q-1	KRKKYJDHFWSRDI-UHFFFAOYSA-N	C[OH-]
67561	CH3OH	Methyl alcohol	InChI=1S/CH4O/c1-2/h2H,1H3	OKKJLVBELUTLKV-UHFFFAOYSA-N	CO		Alcool methylique; Alcool metilico; Carbinol; Colonial spirit; Columbian spirit; Columbian spirits; Hydroxymethane; Metanolo; Methanol; Methyl Alcohol; Methyl hydrate; Methyl hydroxide; Methylalkohol; Methylol; Metylowy alkohol; Monohydroxymethane; Pyroxylic spirit; Wood alcohol; Wood spirit; Wood naphtha
67561	CH3OH+	Methyl alcohol cation	InChI=1S/CH4O/c1-2/h2H,1H3/q+1	GTZIRXXNRBNPPU-UHFFFAOYSA-N	C[OH+]
67561	CH3OH+	Methyl alcohol cation	InChI=1/CH4O/c1-2/h2H,1H3/q+1	GTZIRXXNRBNPPU-UHFFFAOYNA-N	C[OH+]
67561	CH3OH+	Methyl alcohol cation	InChI=1S/CH4O/c1-2/h2H,1H3/q+1	GTZIRXXNRBNPPU-UHFFFAOYSA-N	C[OH+]
323194327	NH2OH2+	protonated hydroxylamine	InChI=1S/H3NO/c1-2/h2H,1H2/p+1		N[OH2+]
33	H2ONH3	Water Ammonia Dimer	InChI=1S/H5NO/c1-3-2/h2H,1H3	SPYQWCOYCDNQJZ-UHFFFAOYSA-N	N.O
22206742	H5O2+	Dihydroxonium ion	InChI=1S/2H2O/h2*1H2/p+1	YBSGOCLVQAVBDW-UHFFFAOYSA-N	[OH3+].[OH2]		Diaquahydrogen ion; Zundel cation
9000371	CH3OH2+	Methanol, protonated	InChI=1S/CH4O/c1-2/h2H,1H3/p+1	OKKJLVBELUTLKV-UHFFFAOYSA-O	C[OH2+]
7789244	LiF-	lithium fluoride anion	InChI=1S/FH.Li/h1H;/p-1	MDGGAEUUFAWUTG-UHFFFAOYSA-M	[Li][F-]
7789244	LiF	lithium fluoride	InChI=1S/FH.Li/h1H;/q;+1/p-1	PQXKHYXIUOZZFA-UHFFFAOYSA-M	[Li]F		Fluorolithium; Lithium fluoride; Lithium fluoride (Li3F3); Lithium fluoride (LiF); Lithium fluorure; Lithium monofluoride; NTL 50; TLD 100; TLD 700; Trilithium trifluoride
7789244	LiF+	lithium fluoride cation	InChI=1S/FH.Li/h1H;/q;+2/p-1	VOIKZQGSXXBFOJ-UHFFFAOYSA-M	[Li+]F
7782414	F2-	flourine diatomic anion	InChI=1S/F2/c1-2/q-1	KVOOTFCSKAFKLT-UHFFFAOYSA-N	[F-]F
7782414	F2	Fluorine diatomic	InChI=1S/F2/c1-2	PXGOKWXKJXAPGV-UHFFFAOYSA-N	FF		Bifluoriden; Fluor; Fluorine; Fluorine, compressed; Fluoro; Fluorures acide; Fluoruri acidi; Saeure fluoride; difluorine
7782414	F2+	flourine diatomic cation	InChI=1S/F2/c1-2/q+1	PCZTVBPMAMPCIP-UHFFFAOYSA-N	[F+]F
12061700	FO-	flourine oxide anion	InChI=1S/FO/c1-2/q-1	VMUWIFNDNXXSQA-UHFFFAOYSA-N	F[O-]
12061700	FO	Oxygen monofluoride	InChI=1S/FO/c1-2	FXOFAYKVTOLJTJ-UHFFFAOYSA-N	F[O]		Oxygen fluoride
12061700	FO+	fluorine monoxide cation	InChI=1S/FO/c1-2/q+1	AYDJPXZJMHGWTB-UHFFFAOYSA-N	F[O+]
13768600	BF-	Boron monofluoride anion	InChI=1S/BF/c1-2/q-1	QXOGQXNQKDPDKB-UHFFFAOYSA-N	[B][F-]
13768600	BF	Boron monofluoride	InChI=1S/BF/c1-2	YFSQMOVEGCCDJL-UHFFFAOYSA-N	[B]F		Fluoroborane
13768600	BF+	Boron monofluoride cation	InChI=1S/BF/c1-2/q+1	FHUWYTSDAXHJFL-UHFFFAOYSA-N	[B+]F
13597961	BeF-	Beryllium monofluoride anion	InChI=1S/Be.FH/h;1H/p-1	HXWIRARPQGBRJQ-UHFFFAOYSA-M	[Be][F-]
13597961	BeF	Beryllium monofluoride	InChI=1S/Be.FH/h;1H/q+1;/p-1	ROPFUFXLORQKEY-UHFFFAOYSA-M	[Be]F		Beryllium fluoride
13597961	BeF+	Beryllium monofluoride cation	InChI=1S/Be.FH/h;1H/q+2;/p-1	VPZVBOPEQYBHOB-UHFFFAOYSA-M	[Be+]F
13967061	NF-	nitrogen monofluorine anion	InChI=1S/FN/c1-2/q-1	VVRUJRUIQRESLT-UHFFFAOYSA-N	[N-]F		Fluoroimidogen anion
13967061	NF	nitrogen fluoride	InChI=1S/FN/c1-2	CMUBZTZNXGBJMQ-UHFFFAOYSA-N	[N]F		Fluoroimidogen
13967061	NF+	nitrogen monofluoirde cation	InChI=1S/FN/c1-2/q+1	NUTZSMVASAAMLV-UHFFFAOYSA-N	[N+]F		Fluoroimidogen cation
3889756	CF-	carbon monofluoride anion	InChI=1S/CF/c1-2/q-1	DMDPHEHMMGEGQC-UHFFFAOYSA-N	[C-]F
3889756	CF	Fluoromethylidyne	InChI=1S/CF/c1-2	ISOSXCFSIDVNNC-UHFFFAOYSA-N	[C]F		Fluoromethylidyne
3889756	CF+	carbon monofluoride cation	InChI=1S/CF/c1-2/q+1	LDIFHDJQDDMHHQ-UHFFFAOYSA-N	[C+]F
14034798	HOF	Hypofluorous acid	InChI=1S/FHO/c1-2/h2H	AQYSYJUIMQTRMV-UHFFFAOYSA-N	FO		Hypofluorous acid
18130740	FHF-	Hydrogen difluoride anion	InChI=1S/F2H/c1-3-2/q-1	LJRMFMQHZAVYNS-UHFFFAOYSA-N	F.F		Hydrogen difluoride anion
18130740	FHF	Hydrogen difluoride	InChI=1S/2FH/h2*1H	CUPFNGOKRMWUOO-UHFFFAOYSA-N	F.F
13453526	HCF	Fluoromethylene	InChI=1S/CHF/c1-2/h1H	YUCFVHQCAFKDQG-UHFFFAOYSA-N	[CH]F		Fluoromethylene
9000919	F2H+	Fluorine, protonated	InChI=1S/F2H/c1-2/h1H/q+1	RKUNWRMJYQSYIK-UHFFFAOYSA-N	F[FH+]
30664121	H2F2	Hydrogen fluoride dimer	InChI=1S/F2H2/c1-3-2/h1H	WGRFAFFYKGIUGZ-UHFFFAOYSA-N	F.F		Hydrogen fluoride dimer
15861059	NH2F	monofluoroamine	InChI=1S/FH2N/c1-2/h2H2	MDQRDWAGHRLBPA-UHFFFAOYSA-N	NF		Monofluoroammonia; Fluoroamine
3744294	CH2F	fluoromethyl radical	InChI=1S/CH2F/c1-2/h1H2	VUWZPRWSIVNGKG-UHFFFAOYSA-N	[CH2]F		Methyl, fluoro-; Methyl radical, fluoro-
3744294	CH2F+	fluoromethyl cation	InChI=1S/CH2F/c1-2/h1H2/q+1		[CH2+]F		Fluoromethylium
558214	CD3F	methylfluoride-d3	InChI=1S/CH3F/c1-2/h1H3/i1D3	NBVXSUQYWXRMNV-FIBGUPNXSA-N	CF		Fluoromethane-d3
593533	CH3F	Methyl fluoride	InChI=1S/CH3F/c1-2/h1H3	NBVXSUQYWXRMNV-UHFFFAOYSA-N	CF		Fluoromethane; Freon 41; Methane, fluoro-; Methyl fluoride
593533	CH3F+	methyl fluoride cation	InChI=1S/CH3F/c1-2/h1H3/q+1		[CH3+]F
12521470	LiNe+	Lithium Neon cation	InChI=1S/Li.Ne/q+1;		[Li+][Ne]
12185056	Ne2	Neon diatomic	InChI=1S/Ne2/c1-2	AOYLJFJXTMPVQU-UHFFFAOYSA-N	[Ne][Ne]
12185056	Ne2+	Neon diatomic cation	InChI=1S/Ne2/c1-2/q+1	ZWVRTUFYOQFTNE-UHFFFAOYSA-N	[Ne+][Ne]
12333492	NaLi-	lithium sodium anion	InChI=1S/Li.Na/q-1;	YRVOGPYJQZFITP-UHFFFAOYSA-N	[Na][Li-]
12333492	NaLi-	lithium sodium anion	InChI=1/Li.Na/q;-1/rLiNa/c1-2/q-1	YRVOGPYJQZFITP-CZHMQCEGNA-N	[Na][Li-]
12333492	NaLi	lithium sodium	InChI=1S/Li.Na	VVNXEADCOVSAER-UHFFFAOYSA-N	[Na][Li]
12333492	NaLi	lithium sodium	InChI=1/Li.Na/rLiNa/c1-2	VVNXEADCOVSAER-BUZOBWEENA-N	[Li][Na]
12333492	NaLi+	lithium sodium cation	InChI=1S/Li.Na/q;+1	QTZZYFLLQVLUNF-UHFFFAOYSA-N	[Na][Li+]
12333492	NaLi+	lithium sodium cation	InChI=1/Li.Na/q;+1/rLiNa/c1-2/q+1	QTZZYFLLQVLUNF-NARQAQEANA-N	[Li][Na+]
25681792	Na2-	sodium diatomic anion	InChI=1S/2Na/q;-1	BNGLLXLLJXMLTN-UHFFFAOYSA-N	[Na]=[Na-]
25681792	Na2-	sodium diatomic anion	InChI=1/2Na/q;-1/rNa2/c1-2/q-1	BNGLLXLLJXMLTN-OKUGHGEBNA-N	[Na]=[Na-]
25681792	Na2	Sodium diatomic	InChI=1S/2Na	QXNVGIXVLWOKEQ-UHFFFAOYSA-N	[Na][Na]		Sodium; Sodium dimer; disodium
25681792	Na2+	sodium diatomic cation	InChI=1S/2Na/q;+1	YWCMJCGHOWDIIZ-UHFFFAOYSA-N	[Na][Na+]
25681792	Na2+	sodium diatomic cation	InChI=1/2Na/q;+1/rNa2/c1-2/q+1	YWCMJCGHOWDIIZ-TWAVBOHPNA-N	[Na][Na+]
9000368	NaBe	Sodium Beryllium	InChI=1S/Be.Na	ONDNJMVOFFRRKV-UHFFFAOYSA-N	[Na][Be]
9000368	NaBe	Sodium Beryllium	InChI=1/Be.Na/rBeNa/c1-2	ONDNJMVOFFRRKV-ZVNBMPAFNA-N	[Be][Na]
12401864	NaO-	sodium oxide anion	InChI=1S/Na.O/q;-1	BDJROSQLJNXSHE-UHFFFAOYSA-N	[O-].[Na]
12401864	NaO-	sodium oxide anion	InChI=1/Na.O/q;-1/rNaO/c1-2/q-1	BDJROSQLJNXSHE-CRUIXLRBNA-N	[O-].[Na] [O-][Na]
12401864	NaO	sodium monoxide	InChI=1S/Na.O	IVAOQJNBYYIDSI-UHFFFAOYSA-N	[Na][O]		Calcined soda; Sodium monoxide; Sodium oxide
12401864	NaO+	sodium oxide cation	InChI=1S/Na.O/q+1;	MOTFHFGUYDZINO-UHFFFAOYSA-N	[Na+][O]
12401864	NaO+	sodium oxide cation	InChI=1/Na.O/q+1;/rNaO/c1-2/q+1	MOTFHFGUYDZINO-LPHZKHJKNA-N	O=[Na+]
1310732	NaOH	sodium hydroxide	InChI=1S/Na.H2O/h;1H2/q+1;/p-1	HEMHJVSKTPXQMS-UHFFFAOYSA-M	[Na]O		Aetznatron; Ascarite; Caustic soda; Collo-Grillrein; Collo-Tapetta; Fuers Rohr; Hydroxyde de sodium; Liquid-plumr; Lye; Natriumhydroxid; Natriumhydroxyde; Plung; Rohrputz; Rohrreiniger Rofix; Soda lye; Soda, caustic; Sodio(idrossido di); Sodium hydrate; Sodium Hydroxide; Sodium hydroxide (Na(OH)); Sodium hydroxide, anhydrous; Sodium(hydroxyde de); White caustic
7681494	NaF-	sodium fluoride anion	InChI=1S/FH.Na/h1H;/p-1	SRLLRIILXLQLHZ-UHFFFAOYSA-M	[Na][F-]
7681494	NaF	sodium fluoride	InChI=1S/FH.Na/h1H;/q;+1/p-1	PUZPDOWCWNUUKD-UHFFFAOYSA-M	[Na]F		Fluoride, sodium; Sodium Fluoride; Sodium monofluoride; Villiaumite
7681494	NaF+	sodium fluoride cation	InChI=1S/F.Na/q;+1	DWGKQXLFIDDJLI-UHFFFAOYSA-N	[Na+]F
9000370	NaMg	Sodium Magnesium	InChI=1S/Mg.Na	NEMFQSKAPLGFIP-UHFFFAOYSA-N	[Na][Mg]
9000370	NaMg	Sodium Magnesium	InChI=1/Mg.Na/rMgNa/c1-2	NEMFQSKAPLGFIP-PQNAKPCQNA-N	[Na][Mg]
9000367	LiMg	Lithium magnesium	InChI=1S/Li.Mg	GCICAPWZNUIIDV-UHFFFAOYSA-N	[Li][Mg]
9000367	LiMg	Lithium magnesium	InChI=1/Li.Mg/rLiMg/c1-2	GCICAPWZNUIIDV-PEEIPLGNNA-N	[Li][Mg]
29904798	Mg2-	magnesium diatomic anion	InChI=1S/2Mg/q;-1	CISLHUYDBIYHAP-UHFFFAOYSA-N	[Mg]#[Mg-]
29904798	Mg2-	magnesium diatomic anion	InChI=1/2Mg/q;-1/rMg2/c1-2/q-1	CISLHUYDBIYHAP-DMHMWSDXNA-N	[Mg]#[Mg-]
29904798	Mg2	Magnesium diatomic	InChI=1S/2Mg	HZZOEADXZLYIHG-UHFFFAOYSA-N	[Mg]=[Mg]		Magnesium; Magnesium dimer; dimagnesium
29904798	Mg2+	magnesium diatomic cation	InChI=1S/2Mg/q;+1	HRLTYPKXXQLYKW-UHFFFAOYSA-N	[Mg][Mg+]
29904798	Mg2+	magnesium diatomic cation	InChI=1/2Mg/q;+1/rMg2/c1-2/q+1	HRLTYPKXXQLYKW-SNICHUAKNA-N	[Mg][Mg+]
81099061	BeMg	Beryllium Magnesium	InChI=1S/Be.Mg	UEFUYLGMYTWGJW-UHFFFAOYSA-N	[Be][Mg]
60195155	MgN	Magnesium Nitride	InChI=1S/Mg.N		[Mg][N]
1309484	MgO-	magnesium oxide anion	InChI=1S/Mg.O/q-1;	KGNGYGXQTQANKO-UHFFFAOYSA-N	[Mg][O-]
1309484	MgO-	magnesium oxide anion	InChI=1/Mg.O/q;-1/rMgO/c1-2/q-1	UDYXJSKNNDLQKX-BXPLQSITNA-N	[O-][Mg]
1309484	MgO	magnesium oxide	InChI=1S/Mg.O	CPLXHLVBOLITMK-UHFFFAOYSA-N	[Mg]=O		Akro-mag; Animag; Calcined brucite; Calcined magnesia; Calcined magnesite; Granmag; Magcal; Magchem 100; Maglite; Magnesia; Magnesia usta; Magnesium Oxide; Magnesium oxide (MgO); Magnezu tlenek; Magox; Magox 85; Magox 90; Magox 95; Magox 98; Magox op; Marmag; Oxymag; Periclase; Seawater magnesia
1309484	MgO+	magnesium oxide cation	InChI=1S/Mg.O/q;+1	WWJAFWJWKCNAED-UHFFFAOYSA-N	[Mg+][O]
12141116	MgOH	magnesium hydroxide	InChI=1S/Mg.H2O/h;1H2/q+1;/p-1	UNYOJUYSNFGNDV-UHFFFAOYSA-M	[Mg]O		Magnesium hydroxide
12141116	MgOH	magnesium hydroxide	InChI=1S/Mg.H2O/h;1H2/q+1;/p-1	UNYOJUYSNFGNDV-UHFFFAOYSA-M	[OH-].[Mg+]		Magnesium hydroxide
14953287	MgF-	magnesium fluoride anion	InChI=1S/FH.Mg/h1H;/p-1	YCMRNUFUPJPNJS-UHFFFAOYSA-M	[Mg][F-]
14953287	MgF-	magnesium fluoride anion	InChI=1/FH.Mg/h1H;/p-1/rFMg/c1-2/q-1	YCMRNUFUPJPNJS-NQXQAOKTNA-M	[Mg][F-]
14953287	MgF	Magnesium monofluoride	InChI=1S/FH.Mg/h1H;/q;+1/p-1	WSXHQDSJUJYQDO-UHFFFAOYSA-M	[Mg]F		Magnesium fluoride
14953287	MgF+	magnesium fluoride cation	InChI=1S/FH.Mg/h1H;/q;+2/p-1	IVKQCNNOVDWFRO-UHFFFAOYSA-M	[Mg+]F
39422247	NaAl	Sodium aluminum	InChI=1S/Al.Na		[Na][Al]
32752946	Al2-	aluminum diatomic anion	InChI=1S/2Al/q;-1	IDPICEGAWIXDJU-UHFFFAOYSA-N	[Al]#[Al-]
32752946	Al2-	aluminum diatomic anion	InChI=1/2Al/q;-1/rAl2/c1-2/q-1	IDPICEGAWIXDJU-WZCMVCQXNA-N	[Al]#[Al-]
32752946	Al2	Aluminum diatomic	InChI=1S/2Al	QSDQMOYYLXMEPS-UHFFFAOYSA-N	[Al]#[Al]		Aluminum; dialuminum
32752946	Al2+	aluminum diatomic cation	InChI=1S/2Al/q;+1	FTMHZEODMLVFLK-UHFFFAOYSA-N	[Al]=[Al+]
12042374	LiAl	Lithium Aluminum	InChI=1S/Al.Li		[Li][Al]
12250429	BAl	Boron Aluminum	InChI=1S/Al.B	OLPJLZLFBXJWKN-UHFFFAOYSA-N	[B][Al]
12004307	Al2H6	dialane	InChI=1S/2Al.6H	VRAIHTAYLFXSJJ-UHFFFAOYSA-N
12004307	Al2H6	dialane	InChI=1/2Al.6H/rAl2H6/c3-1-2(3)4-1/h1-2H2	VRAIHTAYLFXSJJ-UXBQRSFMNA-N
37265944	AlC	Aluminum carbide	InChI=1S/C.Al	CGOMEZFCOFKDAD-UHFFFAOYSA-N	[Al]=[C]
24304005	AlN-	aluminum mononitride anion	InChI=1S/Al.N/q;-1	FEODAVSWLJSVMT-UHFFFAOYSA-N	[Al]=[N-]
24304005	AlN-	aluminum mononitride anion	InChI=1/Al.N/q;-1/rAlN/c1-2/q-1	FEODAVSWLJSVMT-FULZEAINNA-N	[Al]=[N-]
24304005	AlN	Aluminum nitride	InChI=1S/Al.N	PIGFYZPCRLYGLF-UHFFFAOYSA-N	[Al]#N
24304005	AlN+	aluminum mononitride cation	InChI=1S/Al.N/q+1;	FOULOHQKOXGYKD-UHFFFAOYSA-N	[Al+]=[N]
14457648	AlO-	Aluminum monoxide anion	InChI=1S/Al.O/q;-1	CFOAGJJIFDBIGW-UHFFFAOYSA-N	[Al][O-]
14457648	AlO	Aluminum monoxide	InChI=1S/Al.O	AIRCTMFFNKZQPN-UHFFFAOYSA-N	[Al]=O		Aluminum oxide
14457648	AlO+	aluminum monoxide cation	InChI=1S/Al.O/q+1;	AENDPCOLKHDBIA-UHFFFAOYSA-N	[Al+]=O
14457648	AlO+	aluminum monoxide cation	InChI=1/Al.O/q+1;/rAlO/c1-2/q+1	AENDPCOLKHDBIA-JWQLGQMPNA-N	[Al+]=O
13595829	AlF-	Aluminum monofluoride anion	InChI=1S/Al.FH/h;1H/p-1	MLRRTXJBDYYWFO-UHFFFAOYSA-M	[Al][F-]
13595829	AlF-	Aluminum monofluoride anion	InChI=1/Al.FH/h;1H/p-1/rAlF/c1-2/q-1	MLRRTXJBDYYWFO-ODKZLNRCNA-M	[Al][F-]
13595829	AlF	Aluminum monofluoride	InChI=1S/Al.FH/h;1H/q+1;/p-1	APURLPHDHPNUFL-UHFFFAOYSA-M	[Al]F		Aluminum fluoride; Aluminum monofluoride; aluminum(I) fluoride
13595829	AlF+	Aluminum monofluoride cation	InChI=1S/Al.FH/h;1H/q+2;/p-1	RGHMOOXWBKVSBE-UHFFFAOYSA-M	[Al+]F
13595829	AlF+	Aluminum monofluoride cation	InChI=1/Al.FH/h;1H/q+2;/p-1/rAlF/c1-2/q+1	RGHMOOXWBKVSBE-GZCZCILFNA-M	[Al+]F
12589025	BSi	Boron silicide	InChI=1S/BSi/c1-2		[B]=[Si]		Boron Silicon diatomic
12597352	Si2-	silcon diatomic anion	InChI=1S/Si2/c1-2/q-1	ZJQANMVDLHPKNU-UHFFFAOYSA-N	[Si]#[Si-]
12597352	Si2	Silicon diatomic	InChI=1S/Si2/c1-2	NTQGILPNLZZOJH-UHFFFAOYSA-N	[Si]=[Si]		Silicon dimer; silicon dimer ; disilicon
12597352	Si2+	silcon diatomic cation	InChI=1S/Si2/c1-2/q+1	MEMLCQNRJARANC-UHFFFAOYSA-N	[Si]#[Si+]
409212	SiC-	silicon monocarbide anion	InChI=1S/CSi/c1-2/q-1	JIEIEMAFCBWKKB-UHFFFAOYSA-N	[Si]#[C-]
409212	SiC	silicon monocarbide	InChI=1S/CSi/c1-2	HBMJWWWQQXIZIP-UHFFFAOYSA-N	[Si]#[C]		Silicon carbide
409212	SiC+	silicon monocarbide cation	InChI=1S/CSi/c1-2/q+1	ONANOXGDHXUCRI-UHFFFAOYSA-N	[Si]#[C+]
36835582	Si2H2	disilyne	InChI=1S/H2Si2/c1-2/h1-2H		[SiH]#[SiH]		disilicon dihydride
36835582	Si2H2	disilyne	InChI=1S/H2Si2/c1-2/h1-2H		[SiH]=[SiH]		disilicon dihydride
36835582	Si2H2	disilyne	InChI=1S/H4Si2/c1-2/h1-2H		[SiH2][SiH2]		disilicon dihydride
36835582	Si2H2	disilyne	InChI=1S/H4Si2/c1-2/h1-2H		[Si]1H[SiH]1		disilicon dihydride
51067846	CH2SiH2	silaethylene	InChI=1S/CH4Si/c1-2/h1-2H2	CBZNDCXNWNCBHK-UHFFFAOYSA-N	C=Si
15435775	Si2H4	Disilene	InChI=1S/H4Si2/c1-2/h1-2H2		[SiH2]=[SiH2]		disilaethylene; disilylene
15435775	Si2H4	Disilene	InChI=1S/H4Si2/c1-2/h1-2H2		[SiH2]-[SiH2]		disilaethylene; disilylene
15435775	Si2H4	Disilene	InChI=1S/H4Si2/c1-2/h1-2H2		[H]1[SiH]2[SiH]1[H]2		disilaethylene; disilylene
1590870	Si2H6	disilane	InChI=1S/H6Si2/c1-2/h1-2H3	PZPGRFITIJYNEJ-UHFFFAOYSA-N	[SiH3][SiH3]		Disilane; Silicoethane
992949	CH3SiH3	methyl silane	InChI=1S/CH6Si/c1-2/h1-2H3	UIUXUFNYAYAMOE-UHFFFAOYSA-N	[SiH3]C		Methylsilane; Silaethane; Silane, methyl-
12033602	SiN-	silicon mononitride anion	InChI=1S/NSi/c1-2/q-1	HJLUGXGKUYDMTQ-UHFFFAOYSA-N	[Si]=[N-]
12033602	SiN	Silicon nitride	InChI=1S/NSi/c1-2	NCLWWTWAYQTPBU-UHFFFAOYSA-N	[Si]#N		Silicon nitride; Silicon nitride (SiN)
12033602	SiN+	silicon mononitride cation	InChI=1S/NSi/c1-2/q+1	DTKKAOJCCCLENN-UHFFFAOYSA-N	[Si+]#N
13598782	SiH3NH2	Silane, amino	InChI=1S/H5NSi/c1-2/h1H2,2H3		[SiH3]N		Silanamine; Silylamine; Aminosilane; Silicyl amide
10097286	SiO-	silicon monoxide anion	InChI=1S/OSi/c1-2/q-1	KPCFRGHQOVXAQS-UHFFFAOYSA-N	[Si-]=O
10097286	SiO	Silicon monoxide	InChI=1S/OSi/c1-2	LIVNPJMFVYWSIS-UHFFFAOYSA-N	[Si][O]		Silicon monoxide; Silicon oxide; Silicon(II) oxide; Silylene, oxo-
10097286	SiO+	silicon monoxide cation	InChI=1S/OSi/c1-2/q+1	PWVRFXMLYJICKR-UHFFFAOYSA-N	[Si]#[O+]
14475388	SiH3OH	silanol	InChI=1S/H4OSi/c1-2/h1H,2H3		[SiH3]O		Hydroxysilane
11128248	SiF-	silicon monofluoride anion	InChI=1S/FSi/c1-2/q-1	KUUGDSIWSVFCGC-UHFFFAOYSA-N	[Si-]F
11128248	SiF	silicon monofluoride	InChI=1S/FSi/c1-2	ZHPNWZCWUUJAJC-UHFFFAOYSA-N	[Si]F		Fluorosilylidyne; Silicon fluoride; Silylidyne, fluoro-
11128248	SiF+	silicon monofluoride cation	InChI=1S/FSi/c1-2/q+1	WZSRQTCBMBRHIN-UHFFFAOYSA-N	[Si]=[F+]
50561303	HSiF	fluorosilylene	InChI=1S/FHSi/c1-2/h2H		[SiH]F		silylene, fluoro-
13537332	SiH3F	monofluorosilane	InChI=1S/FH3Si/c1-2/h2H3	XPBBUZJBQWWFFJ-UHFFFAOYSA-N	[SiH3]F		Fluorosilane; Silane, fluoro-
12326851	CP-	carbon monophosphide anion	InChI=1S/CP/c1-2/q-1	UVQWQOUGJCVJLT-UHFFFAOYSA-N	[C-]#P
12326851	CP	Carbon monophosphide	InChI=1S/CP/c1-2	GDPLAAHPHNAIGW-UHFFFAOYSA-N	[C]=[P]		Carbon phosphide
12326851	CP+	carbon monophosphide cation	InChI=1S/CP/c1-2/q+1	QQOZTKRLBULFQD-UHFFFAOYSA-N	[C]#[P+]
12259482	LiP	Lithium monophosphide	InChI=1S/Li.P		[Li][P]
12185090	P2-	phosphorus diatomic anion	InChI=1S/P2/c1-2/q-1	NDHYILTXGGVEAB-UHFFFAOYSA-N	[P]=[P-]
12185090	P2	Phosphorus diatomic	InChI=1S/P2/c1-2	FOBPTJZYDGNHLR-UHFFFAOYSA-N	P#P		Phosphorus; Phosphorus dimer; phosphorus(III) phosphide
12185090	P2+	phosphorus diatomic cation	InChI=1S/P2/c1-2/q+1	GSQBFINVLXKPNU-UHFFFAOYSA-N	P#[P+]
12137643	SiP-	Silicon monophosphide anion	InChI=1S/PSi/c1-2/q-1	XUQPLOSHMXQBBQ-UHFFFAOYSA-N	[Si]#[P-]
12137643	SiP	Silicon monophosphide	InChI=1S/PSi/c1-2	FLRSUSDJUOANNM-UHFFFAOYSA-N	[Si]#P
12137643	SiP+	Silicon monophosphide cation	InChI=1S/PSi/c1-2/q+1	CPJSRFNXHFFPHA-UHFFFAOYSA-N	[Si]#[P+]
17739478	PN-	phosphorus nitride anion	InChI=1S/NP/c1-2/q-1	CMKZENUPWBHOLO-UHFFFAOYSA-N	[P]=[N-]
17739478	PN	Phosphorus mononitride	InChI=1S/NP/c1-2	AOPJVJYWEDDOBI-UHFFFAOYSA-N	P#N		Phosphorous nitride; Phosphorus nitride
17739478	PN+	phosphorus nitride cation	InChI=1S/NP/c1-2/q+1	AWCKEWBQZYTNFT-UHFFFAOYSA-N	P#[N+]
20859738	AlP	Aluminum monophosphide	InChI=1S/Al.P	PPNXXZIBFHTHDM-UHFFFAOYSA-N	[Al]#P
20205918	BP	Boron monophosphide	InChI=1S/BP/c1-2	FFBGYFUYJVKRNV-UHFFFAOYSA-N	B#P
13817066	HPO	Hydrogen phosphorus oxide	InChI=1S/HOP/c1-2/h1H	DMGNFLJBACZMRM-UHFFFAOYSA-N	P=O		Oxophosphine
13817066	HPO+	Hydrogen phosphorus oxide cation	InChI=1S/HOP/c1-2/h2H/q+1	LDPFQYNIASWZRM-UHFFFAOYSA-N	[PH+]=O
6829523	HCP	Phosphaethyne	InChI=1S/CHP/c1-2/h1H	DPYPSJGRRFKXBE-UHFFFAOYSA-N	C#P		CHP; Methinophosphide; Phosphaethyne; methylidynephosphine; Phosphine, methylidyne-
6829523	HCP+	Phosphaethyne cation	InChI=1S/CHP/c1-2/h1H/q+1		C#[P+]		Methinophosphide cation; Phosphaethyne radical cation
61183537	CH2PH	Phosphaethene	InChI=1S/CH3P/c1-2/h2H,1H2	HIQXJRBKNONWAH-UHFFFAOYSA-N	[CH2]=[PH]		Phosphaethene; methylenephosphane
13445506	P2H4	Diphosphine	InChI=1S/H4P2/c1-2/h1-2H2	VURFVHCLMJOLKN-UHFFFAOYSA-N	PP		Diphosphine; Biphosphine
593544	CH3PH2	Methyl phosphine	InChI=1S/CH5P/c1-2/h2H2,1H3	SAWKFRBJGLMMES-UHFFFAOYSA-N	PC		Methylphosphane; Phosphine, methyl-; methylphosphine
56898761	CH3PH3+	methyl phosphine, protonated	InChI=1S/CH5P/c1-2/h2H2,1H3/p+1	SAWKFRBJGLMMES-UHFFFAOYSA-O	C[PH3+]		methylphophoranyl cation
19121563	BH3PH3	borane phosphine	InChI=1S/BH6P/c1-2/h1-2H3		[BH3-][PH3+]		Borane-phosphine (1:1); Boron, trihydro(phosphine)​-
14452665	PO-	phosphorus monoxide anion	InChI=1S/OP/c1-2/q-1	SFBRJKRKUUTKHL-UHFFFAOYSA-N	[P-]=O
14452665	PO	Phosphorus monoxide	InChI=1S/OP/c1-2	LFGREXWGYUGZLY-UHFFFAOYSA-N	[P]=O		Phosphorus oxide
14452665	PO+	phosphorus monoxide cation	InChI=1S/OP/c1-2/q+1	OWAFMGZRZPLCGM-UHFFFAOYSA-N	O=[P+]
13840409	H3PO	Phosphine oxide	InChI=1S/H3OP/c1-2/h2H3	MPQXHAGKBWFSNV-UHFFFAOYSA-N	[PH3][O]
25756870	H2POH	Phosphinous acid	InChI=1S/H3OP/c1-2/h1H,2H2	RYIOLWQRQXDECZ-UHFFFAOYSA-N	PO
25756870	H2POH	Phosphinous acid	InChI=1S/H3OP/c1-2/h1H,2H2	RYIOLWQRQXDECZ-UHFFFAOYSA-N	PO
16027922	PF-	phosphorus monofluoride anion	InChI=1S/FP/c1-2/q-1	KEZNWIPFMLYSGH-UHFFFAOYSA-N	[P][F-]
16027922	PF	phosphorus monofluoride	InChI=1S/FP/c1-2	QUQSORXWLOUIIW-UHFFFAOYSA-N	[P]F		Phosphorus fluoride; Phosphorus monofluoride
16027922	PF+	phosphorus monofluoride cation	InChI=1S/FP/c1-2/q+1	RLTICPCNBDVRPZ-UHFFFAOYSA-N	[P+]F
13827322	SO-	sulfur monoxide anion	InChI=1S/OS/c1-2/q-1	YDTOBKDNPZNIGM-UHFFFAOYSA-N	[S][O-]
13827322	SO-	sulfur monoxide anion	InChI=1S/HOS/c1-2/h2H/p-1	CKIBMZIMKMUBPA-UHFFFAOYSA-M	[S-][O]
13827322	SO	Sulfur monoxide	InChI=1S/OS/c1-2	XTQHKBHJIVJGKJ-UHFFFAOYSA-N	S=O		Sulfur monoxide; Sulfur oxide
13827322	SO+	sulfur monoxide cation	InChI=1S/OS/c1-2/q+1	CYYOEZLVUNBAAF-UHFFFAOYSA-N	[S+]=O
13598226	BeS-	Beryllium monosulfide anion	InChI=1S/Be.S/q;-1	FVCMAVGATTVAJD-UHFFFAOYSA-N	[Be][S-]
13598226	BeS	beryllium sulfide	InChI=1S/Be.S	FQDSYGKTHDFFCM-UHFFFAOYSA-N	[Be]=S		Beryllium sulfide; Beryllium sulfide (BeS)
13598226	BeS+	Beryllium monosulfide cation	InChI=1S/Be.S/q+1;	KWQBMKYTDXSTDQ-UHFFFAOYSA-N	[Be+][S]
23550450	S2-	sulfur diatomic anion	InChI=1S/S2/c1-2/q-1	XUIBOWWEJSQBHU-UHFFFAOYSA-N	[S][S-]
23550450	S2	Sulfur diatomic	InChI=1S/S2/c1-2	MAHNFPMIPQKPPI-UHFFFAOYSA-N	S=S		Sulfur; disulfur
23550450	S2+	sulfur diatomic cation	InChI=1S/S2/c1-2/q+1	YUWMVWRPXKPVMW-UHFFFAOYSA-N	S=[S+]
12401740	LiS	Lithium monosulfide	InChI=1S/Li.S	JDZCKJOXGCMJGS-UHFFFAOYSA-N	[Li][S]
12401740	LiS+	Lithium sulfide cation	InChI=1S/Li.S/q;+1	ZRSVLQQFHMQCTB-UHFFFAOYSA-N	[Li][S+]
12504415	SiS-	silicon monosulfide anion	InChI=1S/SSi/c1-2/q-1	NCVGVEWFMIKLSL-UHFFFAOYSA-N	[Si][S-]
12504415	SiS	silicon monosulfide	InChI=1S/SSi/c1-2	DWFFKGPZNGKUPH-UHFFFAOYSA-N	[Si]=S		Silicon monosulfide; Silicon sulfide; silicon(II) sulfide
12504415	SiS+	silicon monosulfide cation	InChI=1S/SSi/c1-2/q+1	PEBIEMGFJNPPGQ-UHFFFAOYSA-N	[Si+]=S
12228396	BS-	boron monosulfide anion	InChI=1S/BS/c1-2/q-1	NPEODCOHZMOQPS-UHFFFAOYSA-N	[B][S-]
12228396	BS	boron sulfide	InChI=1S/BS/c1-2	CPTTWDDSVZIXIO-UHFFFAOYSA-N	[B]=S		Boron sulfide
12228396	BS+	boron monosulfide cation	InChI=1S/BS/c1-2/q+1	PNXGKTMXUUBZOC-UHFFFAOYSA-N	B#[S+]
12281366	PS-	phosphorus monosulfide anion	InChI=1S/PS/c1-2/q-1	AWWBASURNVMANW-UHFFFAOYSA-N	[P][S-]
12281366	PS	phosphorus sulfide	InChI=1S/PS/c1-2	VKCLPVFDVVKEKU-UHFFFAOYSA-N	[P]=S		Phosphorus sulfide
12281366	PS+	phosphorus monosulfide cation	InChI=1S/PS/c1-2/q+1	WEKCTOSOWWEJEE-UHFFFAOYSA-N	[P+]=S
12251900	AlS-	aluminum monosulfide anion	InChI=1S/Al.S/q;-1	KNXXUHKICMOCRG-UHFFFAOYSA-N	[Al][S-]
12251900	AlS	Aluminum sulfide	InChI=1S/Al.S	SLWLWUJHXQUDJS-UHFFFAOYSA-N	[Al]=S		Aluminum sulfide
12251900	AlS+	aluminum monosulfide cation	InChI=1S/Al.S/q+1;	LDTBXNSCQSHUOV-UHFFFAOYSA-N	[Al+]=S
12033566	NS-	nitrogen sulfide anion	InChI=1S/NS/c1-2/q-1	OAXQFEMDGLNGOT-UHFFFAOYSA-N	[N-]=S
12033566	NS	Mononitrogen monosulfide	InChI=1S/NS/c1-2	QXTCFDCJXWLNAP-UHFFFAOYSA-N	[N]=S		Nitrogen sulfide; Sulfur nitride
12033566	NS+	nitrogen sulfide cation	InChI=1S/NS/c1-2/q+1	AEYFYSDAUZXUEI-UHFFFAOYSA-N	N#[S+]
12032369	MgS-	magnesium sulfide anion	InChI=1S/Mg.S/q;-1	OMNSZBQEMNOTLV-UHFFFAOYSA-N	[Mg][S-]
12032369	MgS	magnesium sulfide	InChI=1S/Mg.S	SMDQFHZIWNYSMR-UHFFFAOYSA-N	[Mg]=S		Magnesium sulfide; Magnesium sulfide (MgS)
12032369	MgS+	magnesium sulfide cation	InChI=1S/Mg.S/q+1;	ADIVIKVYSZQWHT-UHFFFAOYSA-N	[S][Mg+]
2944050	CS-	carbon monosulfide anion	InChI=1S/CS/c1-2/q-1	FSOZVKCVXLMCHJ-UHFFFAOYSA-N	[C-]=S
2944050	CS	carbon monosulfide	InChI=1S/CS/c1-2	DXHPZXWIPWDXHJ-UHFFFAOYSA-N	[C]=S		Carbon sulfide
2944050	CS+	carbon monosulfide cation	InChI=1S/CS/c1-2/q+1	ITHBHNXWPWSYRD-UHFFFAOYSA-N	[C+]=S
115694774	NaS	Sodium sulfide	InChI=1S/Na.S	BNOODXBBXFZASF-UHFFFAOYSA-N	[Na][S]
9000242	HNS-	Sulfur imide anion	InChI=1S/HNS/c1-2/h1H/q-1	LVAUBKGSZLNRAL-UHFFFAOYSA-N	[NH][S-]
9000242	HNS	Sulfur imide	InChI=1S/HNS/c1-2/h1H	GLBQVJGBPFPMMV-UHFFFAOYSA-N	N=S		Iminosulfur; Thionitroxyl
36058283	HCS-	Thioformyl anion	InChI=1S/CHS/c1-2/h1H/q-1	VKAKQBQYOCBNIX-UHFFFAOYSA-N	[CH-]=S
36058283	HCS	Thioformyl radical	InChI=1S/CHS/c1-2/h1H	RIFHJAODNHLCBH-UHFFFAOYSA-N	[CH]=S
36058283	HCS	Thioformyl radical	InChI=1S/CHS/c1-2/h1H	RIFHJAODNHLCBH-UHFFFAOYSA-N	[CH]=S
36058283	HCS+	Thioformyl cation	InChI=1S/CHS/c1-2/h1H/q+1	YOFNWWZZELAVRX-UHFFFAOYSA-N	[CH+]=S
62470717	HSO+	Sulfur Monoxide, S-protonated	InChI=1S/HOS/c1-2/h2H/q+1		[SH+][O]
62803127	SOH	Sulfur Hydroxide	InChI=1S/HOS/c1-2/h1H		[S]O
62803127	SOH+	Sulfur Monoxide, protonated	InChI=1S/HOS/c1-2/h1H/q+1		[S+]O
14457853	HBS	hydrogen boron sulfide	InChI=1S/BHS/c1-2/h1H	WGPDGCGYTCPFPX-UHFFFAOYSA-N	B=S		Boron hydride sulfide; thioxoborane
14541243	HS2	Thiosulfeno radical	InChI=1S/HS2/c1-2/h1H	PYPQFOINVKFSJD-UHFFFAOYSA-N	[S]S
62607447	HOSH	hydrogen thioperoxide	InChI=1S/H2OS/c1-2/h1-2H		SO
13465071	H2S2	Disulfane	InChI=1S/H2S2/c1-2/h1-2H	BWGNESOTFCXPMA-UHFFFAOYSA-N	SS		Dihydrogen disulfide
13465071	H2S2+	hydrogen disulfide cation	InChI=1S/H2S2/c1-2/h1-2H/q+1	JIQKIOAUHYCLRI-UHFFFAOYSA-N	S[SH+]
865361	H2CS-	thioformaldehyde anion	InChI=1S/CH2S/c1-2/h1H2/q-1		[S-][CH2]
865361	H2CS	Thioformaldehyde	InChI=1S/CH2S/c1-2/h1H2	DBTDEFJAFBUGPP-UHFFFAOYSA-N	C=S		Thioformaldehyde; methanethial
865361	H2CS+	thioformaldehyde cation	InChI=1S/CH2S/c1-2/h1H2/q+1	PITNAJWFZQWKRG-UHFFFAOYSA-N	C=[S+]
7175759	CH3S	thiomethoxy	InChI=1S/CH3S/c1-2/h1H3	QSLPNSWXUQHVLP-UHFFFAOYSA-N	C[S]		Methylthio radical
98402358	NH3S	sulfidoazane	InChI=1S/H3NS/c1-2/h1H3		[S-][NH3+]		Nitrogen hydride sulfide
20879509	H2CSH+	Thioformaldehyde, protonated	InChI=1S/CH2S/c1-2/h1H2/p+1	DBTDEFJAFBUGPP-UHFFFAOYSA-O	[SH+]=C
14097008	NH2SH	Thiohydroxylamine	InChI=1S/H3NS/c1-2/h2H,1H2		NS
14097008	NH2SH	Thiohydroxylamine	InChI=1S/H3NS/c1-2/h2H,1H2		NS
74931	CH3SH	Methanethiol	InChI=1S/CH4S/c1-2/h2H,1H3	LSDPWZHWYPCBBB-UHFFFAOYSA-N	CS		Mercaptan methylique; Mercaptomethane; Methaanthiol; Methanethiol; Methanthiol; Methvtiolo; Methyl mercaptan; Methyl sulfhydrate; Methyl thioalcohol; Methylmercaptaan; Metilmercaptano; Thiomethanol
74931	CH3SH+	Methanethiol cation	InChI=1S/CH4S/c1-2/h2H,1H3/q+1	LSDPWZHWYPCBBB-UHFFFAOYSA-N	C[SH+]		53369-41-8
90827842	CH3SH2+	protonated methylsulfide	InChI=1S/CH4S/c1-2/h2H,1H3/p+1	LSDPWZHWYPCBBB-UHFFFAOYSA-O	C[SH2+]		Methyl mercaptan, protonated
16068965	SF-	sulfur monofluoride anion	InChI=1S/FS/c1-2/q-1	AYOGQKFVPLTXLD-UHFFFAOYSA-N	[S-]F
16068965	SF	Monosulfur monofluoride	InChI=1S/FS/c1-2	YNAAFGQNGMFIHH-UHFFFAOYSA-N	[S]F		Sulfur fluoride
16068965	SF+	sulfur monofluoride cation	InChI=1S/FS/c1-2/q+1	MPXBIUQNSONLGM-UHFFFAOYSA-N	S=[F+]
17167554	PCl-	phosphorus monochloride anion	InChI=1S/ClP/c1-2/q-1	HTTQKARNUVOXPX-UHFFFAOYSA-N	[P-]Cl
17167554	PCl	phosphorus chloride	InChI=1S/ClP/c1-2	OKSUCCKLAIZTQH-UHFFFAOYSA-N	[P]Cl		Phosphorus chloride
17167554	PCl+	phosphorus monochloride cation	InChI=1S/ClP/c1-2/q+1	KLVGEFFETWPHOI-UHFFFAOYSA-N	[P]=[Cl+]
14989298	MgCl-	magnesium monochloride anion	InChI=1S/ClH.Mg/h1H;/p-1	FOGVNFMUZXDMTR-UHFFFAOYSA-M	[Cl-][Mg]
14989298	MgCl	magnesium monochloride	InChI=1S/ClH.Mg/h1H;/q;+1/p-1	FOSCDBCOYQJHPN-UHFFFAOYSA-M	[Mg]Cl		Magnesium chloride
14989298	MgCl+	magnesium monochloride cation	InChI=1S/ClH.Mg/h1H;/q;+2/p-1	UMLYWWAZKXNCCM-UHFFFAOYSA-M	[Mg+]Cl
14989301	ClO-	chlorine monoxide anion	InChI=1S/ClO/c1-2/q-1	WQYVRQLZKVEZGA-UHFFFAOYSA-N	[O-]Cl		hypochlorite
14989301	ClO	Monochlorine monoxide	InChI=1S/ClO/c1-2	NHYCGSASNAIGLD-UHFFFAOYSA-N	Cl[O]		Chlorine oxide
14989301	ClO+	chlorine monoxide cation	InChI=1S/ClO/c1-2/q+1	GPDKCNQUFLZMCS-UHFFFAOYSA-N	[O+]Cl
14989323	SCl-	sulfur monochloride anion	InChI=1S/ClS/c1-2/q-1	SWONKXKBBKNEAW-UHFFFAOYSA-N	[S-]Cl
14989323	SCl	sulfur monochloride	InChI=1S/ClS/c1-2	NGDNCZPCIZNCQS-UHFFFAOYSA-N	[S]Cl		Sulfur chloride
14989323	SCl+	sulfur monochloride cation	InChI=1S/ClS/c1-2/q+1	QGRYHBGVSPNWQR-UHFFFAOYSA-N	S=[Cl+]
13966579	SiCl-	silicon monochloride anion	InChI=1S/ClSi/c1-2/q-1	MJZVKNVHJCHQAN-UHFFFAOYSA-N	[Si-]Cl
13966579	SiCl	Clorosilylidyne	InChI=1S/ClSi/c1-2	SLLGVCUQYRMELA-UHFFFAOYSA-N	[Si]Cl		Clorosilylidyne
13966579	SiCl+	silicon monochloride cation	InChI=1S/ClSi/c1-2/q+1	CFMKMSBGONFRNY-UHFFFAOYSA-N	[Si+]Cl
13814501	BeCl-	beryllium monochloride anion	InChI=1S/Be.ClH/h;1H/p-1	HZNAZXJRYRIZPD-UHFFFAOYSA-M	[Be][Cl-]
13814501	BeCl-	beryllium monochloride anion	InChI=1/Be.ClH/h;1H/p-1/rBeCl/c1-2/q-1	HZNAZXJRYRIZPD-NKASXHSXNA-M	[Be-]Cl
13814501	BeCl	beryllium monochloride	InChI=1S/Be.ClH/h;1H/q+1;/p-1	LDIHXRVGMZWMIW-UHFFFAOYSA-M	[Be]Cl		Beryllium chloride
13814501	BeCl+	beryllium monochloride cation	InChI=1S/Be.ClH/h;1H/q+2;/p-1	OZJKWEFHBIQYGU-UHFFFAOYSA-M	[Be+]Cl
13595818	AlCl-	aluminum monochloride anion	InChI=1S/Al.ClH/h;1H/p-1	CFMUQTZUSZJTAW-UHFFFAOYSA-M	[Al][Cl-]
13595818	AlCl	Aluminum monochloride	InChI=1S/Al.ClH/h;1H/q+1;/p-1	IZMHKHHRLNWLMK-UHFFFAOYSA-M	[Al]Cl		Aluminum chloride; Aluminum monochloride; aluminum(I) chloride
13595818	AlCl	Aluminum monochloride	InChI=1/Al.ClH/h;1H/q+1;/p-1/rAlCl/c1-2	IZMHKHHRLNWLMK-XAXYIUINNA-M	[Al]Cl		Aluminum chloride; Aluminum monochloride; aluminum(I) chloride
13595818	AlCl+	aluminum monochloride cation	InChI=1S/Al.ClH/h;1H/q+2;/p-1	CFMUQTZUSZJTAW-UHFFFAOYSA-M	[Al+]Cl
20583555	BCl-	boron monochloride anion	InChI=1S/BCl/c1-2/q-1	YNMCJRROYOHGQK-UHFFFAOYSA-N	[B][Cl-]
20583555	BCl	boron monochloride	InChI=1S/BCl/c1-2	GKCOJTRGYAUVSR-UHFFFAOYSA-N	B#Cl		Boron monochloride; Chloroborane
20583555	BCl+	boron monochloride cation	InChI=1S/BCl/c1-2/q+1	UFRRFTHZMBZYAS-UHFFFAOYSA-N	[B+]Cl
12190759	NCl-	nitrogen monochloride anion	InChI=1S/ClN/c1-2/q-1	QCZSUQYYROQMNS-UHFFFAOYSA-N	[N-]Cl
12190759	NCl	nitrogen monochloride	InChI=1S/ClN/c1-2	FCRWGDJBFPDQPO-UHFFFAOYSA-N	[N]Cl
12190759	NCl+	nitrogen monochloride cation	InChI=1S/ClN/c1-2/q+1	CJYGRGOTNJSGDW-UHFFFAOYSA-N	[N]=[Cl+]
7790898	ClF-	clorine monofluoride anion	InChI=1S/ClF/c1-2/q-1	LDLDQLAJXGYORN-UHFFFAOYSA-N	Cl[F-]
7790898	ClF	Chlorine monofluoride	InChI=1S/ClF/c1-2	OMRRUNXAWXNVFW-UHFFFAOYSA-N	ClF		Chlorine fluoride; Chlorine monofluoride; Chlorofluoride; Fluorine chloride
7790898	ClF+	clorine monofluoride cation	InChI=1S/ClF/c1-2/q+1	BFNXPMYZRJXOIV-UHFFFAOYSA-N	Cl[F+]
7647145	NaCl-	sodium chloride anion	InChI=1S/ClH.Na/h1H;/p-1	OTNVGWMVOULBFZ-UHFFFAOYSA-M	[Na][Cl-]
7647145	NaCl	Sodium Chloride	InChI=1S/ClH.Na/h1H;/q;+1/p-1	FAPWRFPIFSIZLT-UHFFFAOYSA-M	[Na]Cl		Common salt; Halite; Hyposaline; Iodized salt; Natriumchlorid; Rock salt; Saline; Salt; Sea salt; Sodium chloric; Sodium Chloride; Sodium monochloride; Sterling; Table salt; USP sodium chloride
7647145	NaCl+	sodium chloride cation	InChI=1S/ClH.Na/h1H;/q;+2/p-1	KMAHCUJTNYBKDG-UHFFFAOYSA-M	[Na+]Cl
7447418	LiCl-	lithium chloride anion	InChI=1S/ClH.Li/h1H;/p-1	PZLXYMQOCNYUIO-UHFFFAOYSA-M	[Li][Cl-]
7447418	LiCl	lithium chloride	InChI=1S/ClH.Li/h1H;/q;+1/p-1	KWGKDLIKAYFUFQ-UHFFFAOYSA-M	[Li]Cl		Chlorku litu; Chlorure de lithium; Lithium chloride; Lithium chloride (LiCl)
7447418	LiCl+	lithium chloride cation	InChI=1S/ClH.Li/h1H;/q;+2/p-1	RMVAXWALTOISFB-UHFFFAOYSA-M	[Li][Cl+]
7782505	Cl2-	chlorine diatomic anion	InChI=1S/Cl2/c1-2/q-1	CGCDOKHAYHELEG-UHFFFAOYSA-N	[Cl-]Cl
7782505	Cl2	Chlorine diatomic	InChI=1S/Cl2/c1-2	KZBUYRJDOAKODT-UHFFFAOYSA-N	ClCl		Bertholite; Chloor; Chlor; Chlore; Chlorine; Chlorine mol.; Cloro; Molecular chlorine; dichlorine
7782505	Cl2+	chlorine diatomic cation	InChI=1S/Cl2/c1-2/q+1	IPYDCMMBWLZPDH-UHFFFAOYSA-N	[Cl+]Cl
3889767	CCl-	carbon monochloride anion	InChI=1S/CCl/c1-2/q-1	PMHXNYGAOGPVKN-UHFFFAOYSA-N	[C-]Cl
3889767	CCl	carbon monochloride	InChI=1S/CCl/c1-2	BBFYMZCRBPASGM-UHFFFAOYSA-N	[C]Cl		Chloromethylidyne
3889767	CCl+	carbon monochloride cation	InChI=1S/CCl/c1-2/q+1	ALXFPMMCBFNYBQ-UHFFFAOYSA-N	[C+]Cl
2108205	HCCl	Chloromethylene	InChI=1S/CHCl/c1-2/h1H	LKYXEULZVGJVTG-UHFFFAOYSA-N	[CH]Cl
2108205	HCCl	Chloromethylene	InChI=1S/CHCl/c1-2/h1H	LKYXEULZVGJVTG-UHFFFAOYSA-N	[CH]Cl
7790923	HOCl	hypochlorous acid	InChI=1S/ClHO/c1-2/h2H	QWPPOHNGKGFGJK-UHFFFAOYSA-N	ClO		Hypochlorous acid
7790923	HOCl+	hypochlorous acid cation	InChI=1S/ClHO/c1-2/h2H/q+1		O[Cl+]
12015406	Cl2H+	Chlorine, protonated	InChI=1S/Cl2H/c1-2/h1H/q+1	HUIKBYLIJHHEJA-UHFFFAOYSA-N	Cl[ClH+]
70110633	ClFH+	Chlorine fluoride, F-protonated	InChI=1S/ClFH/c1-2/h2H/q+1		Cl[FH+]		Fluorine(1+)​, chlorohydro-
70110644	FClH+	Chlorine fluoride, Cl-protonated	InChI=1S/ClFH/c1-2/h1H/q+1		F[ClH+]
13770224	DOCl	Hypochlorous acid-d	InChI=1S/ClHO/c1-2/h2H/i2D	QWPPOHNGKGFGJK-VMNATFBRSA-N	O(Cl)[2H]		DOCl; Hypochlorous acid-D
13931970	HSiCl	Chlorosilylene	InChI=1S/ClHSi/c1-2/h2H	DESGIDRJCLIWRS-UHFFFAOYSA-N	[SiH]Cl		Silylene, chloro-
10599903	NH2Cl	chloramine	InChI=1S/ClH2N/c1-2/h2H2	QDHHCQZDFGDHMP-UHFFFAOYSA-N	NCl		Chloramide; Chloroamine; Monochloramide; Monochloramine; Monochloroamine; Monochloroammonia
6806866	CH2Cl+	chloromethyl cation	InChI=1S/CH2Cl/c1-2/h1H2/q+1		[CH2+]Cl
1111893	CD3Cl	methyl chloride d3	InChI=1S/CH3Cl/c1-2/h1H3/i1D3	NEHMKBQYUWJMIP-FIBGUPNXSA-N	[2H][C]([2H])([2H])Cl		chloromethane-d3
74873	CH3Cl	Methyl chloride	InChI=1S/CH3Cl/c1-2/h1H3	NEHMKBQYUWJMIP-UHFFFAOYSA-N	CCl		Artic; Chloor-methaan; Chlor-methan; Chloromethane; Chlorure de methyle; Clorometano; Cloruro di metile; Freon 40; Methane, chloro-; Methyl chloride; Methylchlorid; Metylu chlorek; Monochloromethane; R 40
74873	CH3Cl+	Methyl chloride cation	InChI=1S/CH3Cl/c1-2/h1H3/q+1		C[Cl+]
74873	CH3Cl+	Methyl chloride cation	InChI=1S/CH3Cl/c1-2/h1H3/q+1		C[Cl+]
74873	CH3Cl+	Methyl chloride cation	InChI=1S/CH3Cl/c1-2/h1H3/q+1		C[Cl+]
12432483	NH3Cl+	protonated monochloroammonia	InChI=1S/ClH2N/c1-2/h2H2/p+1		[NH3+]Cl		Ammoniumyl chloride; Ammoniumyl chloride cation
13465786	SiH3Cl	chlorosilane	InChI=1S/ClH3Si/c1-2/h2H3	KOPOQZFJUQMUML-UHFFFAOYSA-N	[SiH3]Cl		Chlorosilane; Silane, chloro-
12125029	NH4Cl	Ammonium chloride	InChI=1S/ClH.H3N/h1H;1H3	NLXLAEXVIDQMFP-UHFFFAOYSA-N	N.Cl
65967477	CH3ClH+	methyl chloride, protonated	InChI=1S/CH4Cl/c1-2/h2H,1H3/q+1		C[ClH+]		protonated methyl chloride
12595594	Ar2	Argon diatomic	InChI=1S/2Ar	XMPZLAQHPIBDSO-UHFFFAOYSA-N	[Ar][Ar]
12595594	Ar2+	Argon diatomic cation	InChI=1S/Ar2/c1-2/q+1	HTIFKSFRQRSNHN-UHFFFAOYSA-N	[Ar+][Ar]
12030830	LiK	Lithium Potassium	InChI=1S/K.Li	OBTSLRFPKIKXSZ-UHFFFAOYSA-N	[Li][K]
12056290	NaK	Sodium Potassium	InChI=1S/K.Na	BITYAPCSNKJESK-UHFFFAOYSA-N	[Na][K]
12056290	NaK+	Sodium Potassium diatomic cation	InChI=1S/K.Na.H/q+1;;	MNSZYVKTVLVSAF-UHFFFAOYSA-N	[Na].[K+]
25681805	K2	Potassium diatomic	InChI=1S/2K	ZDHURYWHEBEGHO-UHFFFAOYSA-N	[K][K]
12401706	KO	Potassium monoxide	InChI=1S/K.O	RQPCXPDUSNVHSU-UHFFFAOYSA-N	[K][O]
12401706	KO+	Potassium monoxide cation	InChI=1S/K.O/q;+1	YWUVUBHYCWZIPY-UHFFFAOYSA-N	[K][O+]
1310583	KOH	Potassium hydroxide	InChI=1S/K.H2O/h;1H2/q+1;/p-1	KWYUFKZDYYNOTN-UHFFFAOYSA-M	[K]O
7789233	KF	Potassium Fluoride	InChI=1S/FH.K/h1H;/q;+1/p-1	NROKBHXJSPEDAR-UHFFFAOYSA-M	[K]F
7447407	KCl	Potassium Chloride	InChI=1S/ClH.K/h1H;/q;+1/p-1	WCUXLLCKKVVCTQ-UHFFFAOYSA-M	[K]Cl
12595856	Ca2	Calcium diatomic	InChI=1S/2Ca	CPGKMLVTFNUAHL-UHFFFAOYSA-N	[Ca][Ca]		dicalcium
65380769	CaC	Calcium monocarbide	InChI=1S/C.Ca/q-1;+1		[Ca+]#[C-]		Calcium carbide radical
20548543	CaS	Calcium sulfide	InChI=1S/Ca.S	JGIATAMCQXIDNZ-UHFFFAOYSA-N	[Ca]=S		calcium sulphide
1305788	CaO	Calcium monoxide	InChI=1S/Ca.O	ODINCKMPIJJUCX-UHFFFAOYSA-N	[Ca]=O		Calcium oxide; Lime; Calcia; Calx
12177672	CaOH	Calcium monohydroxide	InChI=1S/Ca.H2O/h;1H2/q+1;/p-1	KIZFHUJKFSNWKO-UHFFFAOYSA-M	[Ca]O
13827264	CaF	Calcium monofluoride	InChI=1S/Ca.FH/h;1H/q+1;/p-1	PMJVACMPRFHIPZ-UHFFFAOYSA-M	[Ca]F
15606710	CaCl	calcium monochloride	InChI=1S/Ca.ClH/h;1H/q+1;/p-1	WGPMOVAPQPJDDK-UHFFFAOYSA-M	[Ca]Cl
12059915	ScO	Scandium monoxide	InChI=1S/O.Sc	AXJFPMGRQPKZLD-UHFFFAOYSA-N	[Sc][O]
14017335	ScF	Scandium monofluoride	InChI=1S/FH.Sc/h1H;/q;+1/p-1	IASCHBSZTVAFET-UHFFFAOYSA-M	[Sc]F
25583204	TiN	Titanium mononitride	InChI=1S/N.Ti	NRTOMJZYCJJWKI-UHFFFAOYSA-N	[Ti][N]
12137201	TiO	Titanium monoxide	InChI=1S/O.Ti	OGIDPMRJRNCKJF-UHFFFAOYSA-N	[Ti][O]
20190061	TiCl	Titanium Monochloride	InChI=1S/ClH.Ti/h1H;/q;+1/p-1	PDBOLQCPEKXSBW-UHFFFAOYSA-M	[Ti]Cl
12035982	VO	Vanadium monoxide	InChI=1S/O.V	IBYSTTGVDIFUAY-UHFFFAOYSA-N	[V][O]
12190704	Cu2	Copper diatomic	InChI=1S/2Cu	ALKZAGKDWUSJED-UHFFFAOYSA-N	[Cu][Cu]
9000231	CuCH3	monomethyl copper	InChI=1S/CH3.Cu/h1H3;	HRNSPWKFRJGQEC-UHFFFAOYSA-N	[Cu]C
9000231	CuCH3	monomethyl copper	InChI=1/CH3.Cu/h1H3;/rCH3Cu/c1-2/h1H3	HRNSPWKFRJGQEC-CRCSLUCGNA-N	[Cu]C
1317380	CuO	Copper Monoxide	InChI=1S/Cu.O	QPLDLSVMHZLSFG-UHFFFAOYSA-N	[Cu]=O		Copper monooxide; Copper(ii) oxide; Cupric oxide; Copper oxide
7758896	CuCl	Copper monochloride	InChI=1S/ClH.Cu/h1H;/q;+1/p-1	OXBLHERUFWYNTN-UHFFFAOYSA-M	[Cu]Cl		Cuprous chloride; Copper(I) chloride; Copper chloride
13478416	CuF	Copper monofluoride	InChI=1S/Cu.FH/h;1H/q+1;/p-1	BMRUOURRLCCWHB-UHFFFAOYSA-M	[Cu]F		Copper fluoride; copper(I) fluoride
115410770	ZnCH2	Zinc methylene	InChI=1S/CH2.Zn/h1H2;	SNESWYIMTAYTPV-UHFFFAOYSA-N	C=[Zn]
115410770	ZnCH2	Zinc methylene	InChI=1S/CH2.Zn/h1H2;	SNESWYIMTAYTPV-UHFFFAOYSA-N	C=[Zn]
42217981	ZnCH3	Zinc monomethyl	InChI=1S/CH3.Zn/h1H3;	BQWIWXUEEOBUTH-UHFFFAOYSA-N	[Zn]C
1314132	ZnO	zinc monoxide	InChI=1S/O.Zn	XLOMVQKBTHCTTD-UHFFFAOYSA-N	[Zn]=O		Zinc oxide; zinc(II) oxide
1314983	ZnS	Zinc sulfide	InChI=1S/S.Zn	WGPCGCOKHWGKJJ-UHFFFAOYSA-N	[Zn][S]
9000139	ZnF-	Zinc monofluoride anion	InChI=1S/FH.Zn/h1H;/p-1	PNJFCQNOBYADBD-UHFFFAOYSA-M	[Zn][F-]
9000139	ZnF	Zinc monofluoride	InChI=1S/FH.Zn/h1H;/q;+1/p-1	XXLJNWABHZTVSW-UHFFFAOYSA-M	[Zn]F
9000139	ZnF+	Zinc monofluoride cation	InChI=1S/FH.Zn/h1H;/q;+2/p-1	RXHSRIRNCBBJAF-UHFFFAOYSA-M	[Zn+]F
9000151	ZnCl	Zinc monochloride	InChI=1S/ClH.Zn/h1H;/q;+1/p-1	ZXYNGLRGFYLTQZ-UHFFFAOYSA-M	[Zn]Cl
39399558	AlGa	Aluminum Gallium	InChI=1S/Al.Ga		[Al][Ga]
39399558	AlGa	Aluminum Gallium	InChI=1S/Al.Ga.2H	DQTRTWKUTYAGKU-UHFFFAOYSA-N	[Al][Ga]
74508240	Ga2	Gallium diatomic	InChI=1S/2Ga	ZRGXNJBDGJRQMD-UHFFFAOYSA-N	[Ga][Ga]
1408277064	BGa	Boron Gallium	InChI=1S/B.Ga	RFZDQLXPTPBDCM-UHFFFAOYSA-N	[B][Ga]
12140588	Ga2H6	digallane	InChI=1S/2Ga.6H	GFQCQFDOQMRGIQ-UHFFFAOYSA-N
12140588	Ga2H6	digallane	InChI=1/2Ga.6H/rGa2H6/c3-1-2(3)4-1/h1-2H2	GFQCQFDOQMRGIQ-DFALRJEUNA-N
12063988	GaP	Gallium monophosphide	InChI=1S/Ga.P	KDNRAIADFXOCMW-UHFFFAOYSA-N	[Ga]#P		Gallium phosphide
25617974	GaN	Gallium mononitride	InChI=1S/Ga.N	JMASRVWKEDWRBT-UHFFFAOYSA-N	[Ga][N]		Gallium nitride
12024087	GaO	Gallium monoxide	InChI=1S/Ga.O	XCZLSTLZPIRTRY-UHFFFAOYSA-N	[Ga]=O
12024101	GaS	Gallium monosulfide	InChI=1S/Ga.S		[Ga]=S		Gallium sulfide
17108859	GaCl	Gallium monochloride	InChI=1S/ClH.Ga/h1H;/q;+1/p-1	XOYLJNJLGBYDTH-UHFFFAOYSA-M	[Ga]Cl
17108859	GaCl+	Gallium monochloride cation	InChI=1S/ClH.Ga/h1H;/q;+2/p-1	UQTZHOXMCYYRHV-UHFFFAOYSA-M	[Ga+]Cl
13966784	GaF	Gallium monofluoride	InChI=1S/FH.Ga/h1H;/q;+1/p-1	CXPXVVXGLWMDKK-UHFFFAOYSA-M	[Ga]F
13966784	GaF+	Gallium monofluoride cation	InChI=1S/FH.Ga/h1H;/q;+2/p-1	DGOJITKNTKQYRA-UHFFFAOYSA-M	[Ga+]F
12596053	Ge2	Germanium diatomic	InChI=1S/Ge2/c1-2	VXGHASBVNMHGDI-UHFFFAOYSA-N	[Ge][Ge]
12334268	GeC	Germanium monocarbide	InChI=1S/CGe/c1-2	DZWOAPKTBKPJAH-UHFFFAOYSA-N	[Ge][C]
145998023	SiGe	Silicon Germanium	InChI=1S/GeSi/c1-2		[Si][Ge]
1449656	GeH3CH3	methyl germane	InChI=1S/CH6Ge/c1-2/h1-2H3	FOTXTBSEOHNRCB-UHFFFAOYSA-N	[GeH3]C
12025320	GeS	Germanium monosulfide	InChI=1S/GeS/c1-2	VDNSGQQAZRMTCI-UHFFFAOYSA-N	[Ge]=S
20619163	GeO	Germanium monoxide	InChI=1S/GeO/c1-2	PVADDRMAFCOOPC-UHFFFAOYSA-N	[Ge][O]		germanium(II) oxide
20619163	GeO+	Germanium monoxide cation	InChI=1S/GeO/c1-2/q+1	KYXFLUPILCZFRT-UHFFFAOYSA-N	[Ge+]=O
14929465	GeF	Germanium monofluoride	InChI=1S/FGe/c1-2	HHFCFXJTAZTLAO-UHFFFAOYSA-N	[Ge]F
14929465	GeF+	Germanium monofluoride cation	InChI=1S/FGe/c1-2/q+1		[Ge+]F
9000388	GeCl	Germanium monochloride	InChI=1S/ClGe/c1-2	MFWRCAQESKCGKS-UHFFFAOYSA-N	[Ge]Cl
9000388	GeCl+	Germanium monochloride cation	InChI=1S/ClGe/c1-2/q+1		[Ge+]Cl
13537309	GeH3F	monofluorogermane	InChI=1S/FGeH3/c1-2/h2H3	BCQKCDCVNZQJKN-UHFFFAOYSA-N	[GeH3]F
13637655	GeH3Cl	monochlorogermane	InChI=1S/ClGeH3/c1-2/h2H3	OWKFZBJFYBIPMX-UHFFFAOYSA-N	[GeH3]Cl		Chlorogermane; Germanium chloride hydride; Germyl chloride; Germane, chloro-
23878468	As2	Arsenic diatomic	InChI=1S/As2/c1-2	FFCZHQLUEDCQKI-UHFFFAOYSA-N	[As]#[As]
26754983	AsN	Arsenic mononitride	InChI=1S/AsN/c1-2	FOVWHVGDSVSEMU-UHFFFAOYSA-N	[As][N]
12255333	AsP	Arsenic monophosphide	InChI=1S/AsP/c1-2	CFLINJYOEUVYMI-UHFFFAOYSA-N	[As][P]
1303000	GaAs	Gallium arsenide	InChI=1S/As.Ga	JBRZTFJDHDCESZ-UHFFFAOYSA-N	[Ga]#[As]
12005991	AsO	Arsenic monoxide	InChI=1S/AsO/c1-2	GPSSQIRGCXEBSH-UHFFFAOYSA-N	[As]=O
12044790	AsS	Arsenic monosulfide	InChI=1S/AsS/c1-2	LAJUJGVZCLKIKB-UHFFFAOYSA-N	[As]=S
17522780	AsCl	Arsenic monochloride	InChI=1S/AsCl/c1-2		[As]Cl
15120135	AsF	Arsenic monofluoride	InChI=1S/AsF/c1-2	VUFLKUMKDWHEMK-UHFFFAOYSA-N	[As]F
16674183	CSe-	Carbon monoselenide anion	InChI=1S/CSe/c1-2/q-1	VMQIAGBKRWJBEG-UHFFFAOYSA-N	[C-]=[Se]
16674183	CSe	Carbon monoselenide	InChI=1S/CSe/c1-2	SPWXVDBGIFDREP-UHFFFAOYSA-N	[C]=[Se]
16674183	CSe+	Carbon monoselenide cation	InChI=1S/CSe/c1-2/q+1	YVWYREXOXRZPAD-UHFFFAOYSA-N	[C+]=[Se]
64171419	LiSe	Lithium monoselenide	InChI=1S/Li.Se		[Li][Se]
12006052	AsSe	Arsenic monoselenide	InChI=1S/AsSe/c1-2	UEQXZDBVFNJKDD-UHFFFAOYSA-N	[As]=[Se]
12033599	NSe	Nitrogen monoselenide	InChI=1S/NSe/c1-2	PWNCVPLOQRESLN-UHFFFAOYSA-N	[N]=[Se]		Selenium nitride
12065100	GeSe	Germanium monoselenide	InChI=1S/GeSe/c1-2		[Ge]=[Se]		germanium selenide
12211006	SiSe	Silicon Monoselenide	InChI=1S/SeSi/c1-2		[Si][Se]		Silicon selenide; Silylene, selenoxo-
12211006	SiSe+	Silicon Monoselenide cation	InChI=1S/SeSi/c1-2/q+1		[Si]=[Se+]
12185170	Se2-	selenium diatomic anion	InChI=1S/Se2/c1-2/q-1	DQTJTQYKOMVIHU-UHFFFAOYSA-N	[Se-]=[Se]
12185170	Se2	Selenium diatomic	InChI=1S/Se2/c1-2	XIMIGUBYDJDCKI-UHFFFAOYSA-N	[Se]=[Se]
12185170	Se2+	selenium diatomic cation	InChI=1S/Se2/c1-2/q+1	VPTDTTKFVJBMIM-UHFFFAOYSA-N	[Se+]=[Se]
12509410	PSe	Phosphorus monoselenide	InChI=1S/PSe/c1-2	DFRFKDSWUNYYGW-UHFFFAOYSA-N	[P]=[Se]		Selenium phosphide
12640890	SeO-	selenium monoxide anion	InChI=1S/OSe/c1-2/q-1	NZTLOYGFDFZXQP-UHFFFAOYSA-N	[Se][O-]
12640890	SeO-	selenium monoxide anion	InChI=1S/HOSe/c1-2/h1H/p-1	VQNPRYUMHLOITA-UHFFFAOYSA-M	[Se][O-]
12640890	SeO	Selenium monoxide	InChI=1S/OSe/c1-2	ZIJTYIRGFVHPHZ-UHFFFAOYSA-N	[Se]=O
12640890	SeO+	selenium monoxide cation	InChI=1S/OSe/c1-2/q+1	HEURKVUSRFQPCK-UHFFFAOYSA-N	[Se+]=O
7446346	SeS-	selenium monosulfide anion	InChI=1S/SSe/c1-2/q-1	MZYYCIPFRAZGGN-UHFFFAOYSA-N	[Se-][S]
7446346	SeS	Selenium monosulfide	InChI=1S/SSe/c1-2	VIDTVPHHDGRGAF-UHFFFAOYSA-N	[Se]=S		Selenium sulphide; Sulfur selenide; selenium monosulfide
7446346	SeS+	selenium monosulfide cation	InChI=1S/SSe/c1-2/q+1	ZQJXAKCXZFQKHJ-UHFFFAOYSA-N	[Se][S+]
24765455	H2Se2	hydrogen diselenide	InChI=1S/H2Se2/c1-2/h1-2H		[SeH][SeH]		Hydrogen selenide; Dihydrogen diselenide
6596505	H2CSe	Selenoformaldehyde	InChI=1S/CH2Se/c1-2/h1H2		C=[Se]		Methaneselenal
204	CH3SeH	Methane selenol	InChI=1S/CH4Se/c1-2/h2H,1H3	APKHDKJWSHYLEU-UHFFFAOYSA-N	C[Se]
21259369	SeCl	Selenium monochloride	InChI=1S/ClSe/c1-2	CQLXIRWXLDRSTJ-UHFFFAOYSA-N	[Se]Cl		Selenium chloride
16846712	SeF	Selenium monofluoride	InChI=1S/FSe/c1-2	MWHREXSRHFCLNE-UHFFFAOYSA-N	[Se]F
15656196	BrO-	Bromine monoxide anion	InChI=1S/BrO/c1-2/q-1	JGJLWPGRMCADHB-UHFFFAOYSA-N	Br[O-]
15656196	BrO	Bromine monoxide	InChI=1S/BrO/c1-2	FMSOWMGJJIHFTQ-UHFFFAOYSA-N	Br[O]
15656196	BrO+	Bromine monoxide cation	InChI=1S/BrO/c1-2/q+1		[Br+]=O
14791572	SiBr	Silicon monobromide	InChI=1S/BrSi/c1-2		[Si]Br		Bromosilylidyne; Silylidyne, bromo-
14791572	SiBr+	Silicon monobromide cation	InChI=1S/BrSi/c1-2/q+1		[Si][Br+]
13967298	NBr	nitrogen monobromide	InChI=1S/BrN/c1-2	YFQFTOCCYRNGIY-UHFFFAOYSA-N	[N]Br		Bromoimidogen
13863417	BrCl-	bromine chloride anion	InChI=1S/BrCl/c1-2/q-1	BJSZBOOCXFXLAH-UHFFFAOYSA-N	Br[Cl-]
13863417	BrCl	Bromine monochloride	InChI=1S/BrCl/c1-2	CODNYICXDISAEA-UHFFFAOYSA-N	BrCl		Bromine chloride; Bromochloride
13863417	BrCl+	bromine chloride cation	InChI=1S/BrCl/c1-2/q+1	XNOJEOTZZFCNFM-UHFFFAOYSA-N	Br[Cl+]
13863597	BrF-	bromine fluoride anion	InChI=1S/BrF/c1-2/q-1	BSQMZVMUMQTUFY-UHFFFAOYSA-N	Br[F-]
13863597	BrF	Bromine monofluoride	InChI=1S/BrF/c1-2	MZJUGRUTVANEDW-UHFFFAOYSA-N	BrF		Bromine fluoride
13863597	BrF+	bromine fluoride cation	InChI=1S/BrF/c1-2/q+1	LFJOEVNIBINABS-UHFFFAOYSA-N	[Br+]F
22359973	AlBr	Aluminum monobromide	InChI=1S/Al.BrH/h;1H/q+1;/p-1		[Al]Br
22655590	GaBr	Gallium monobromide	InChI=1S/BrH.Ga/h1H;/q;+1/p-1		[Ga]Br
19961296	BBr	Boron monobromide	InChI=1S/BBr/c1-2	YXCOLLAIMXVWPV-UHFFFAOYSA-N	[B]Br
59727161	PBr	Phosphorus monobromide	InChI=1S/BrP/c1-2		[P]Br		Bromophosphinidene
74140673	SBr	Sulfur monobromide radical	InChI=1S/BrS/c1-2		[S]Br
74140673	SBr+	Sulfur monobromide cation	InChI=1S/BrS/c1-2/q+1		S=[Br+]
7550358	LiBr-	lithium bromide anion	InChI=1S/BrH.Li/h1H;/p-1	VJHXXNYZXFPCGL-UHFFFAOYSA-M	[Li][Br-]
7550358	LiBr	Lithium Bromide	InChI=1S/BrH.Li/h1H;/q;+1/p-1	AMXOYNBUYSYVKV-UHFFFAOYSA-M	[Li]Br
7550358	LiBr+	lithium bromide cation	InChI=1S/BrH.Li/h1H;/q;+2/p-1	IIIODQJJWFGNMN-UHFFFAOYSA-M	[Li+]Br
7647156	NaBr-	sodium bromide anion	InChI=1S/BrH.Na/h1H;/p-1	BXBUVIPNRGDTNE-UHFFFAOYSA-M	[Na][Br-]
7647156	NaBr	Sodium Bromide	InChI=1S/BrH.Na/h1H;/q;+1/p-1	JHJLBTNAGRQEKS-UHFFFAOYSA-M	[Na]Br
7647156	NaBr+	sodium bromide cation	InChI=1S/BrH.Na/h1H;/q;+2/p-1	ASVMUXWJKLXQQD-UHFFFAOYSA-M	[Na+]Br
7758023	KBr	Potassium Bromide	InChI=1S/BrH.K/h1H;/q;+1/p-1	IOLCXVTUBQKXJR-UHFFFAOYSA-M	[K]Br
7726956	Br2-	bromine diatomic anion	InChI=1S/Br2/c1-2/q-1	LTDXHAFASXANOM-UHFFFAOYSA-N	[Br-]Br
7726956	Br2	Bromine diatomic	InChI=1S/Br2/c1-2	GDTBXPJZTBHREO-UHFFFAOYSA-N	BrBr		Dibromine; Broom; Brome; Bromo; Brom
7726956	Br2+	bromine diatomic cation	InChI=1S/Br2/c1-2/q+1	YZABTPRDHYVJNU-UHFFFAOYSA-N	[Br+]Br
12598708	SeBr	Selenium monobromide	InChI=1S/BrSe/c1-2		[Se]Br
10024438	CaBr	Calcium monobromide	InChI=1S/BrH.Ca/h1H;/q;+1/p-1	NJBLGWVFUHAPEF-UHFFFAOYSA-M	[Ca]Br
3889778	CBr	Carbon monobromide	InChI=1S/CBr/c1-2	AOJDZKCUAATBGE-UHFFFAOYSA-N	[C]Br
13517118	HOBr	Hypobromous acid	InChI=1S/BrHO/c1-2/h2H	CUILPNURFADTPE-UHFFFAOYSA-N	BrO
13517118	HOBr+	Hypobromous acid cation	InChI=1S/BrHO/c1-2/h2H/q+1	XYOOZIOGTBYZIU-UHFFFAOYSA-N	O[Br+]
17141285	CHBr	bromomethylene	InChI=1S/CHBr/c1-2/h1H	PRCFIJGWTCBHPP-UHFFFAOYSA-N	[CH]Br
13569454	HSiBr	monobromosilylene	InChI=1S/BrHSi/c1-2/h2H		[SiH]Br
16519974	CH2Br	bromomethyl radical	InChI=1S/CH2Br/c1-2/h1H2	AOJDZKCUAATBGE-UHFFFAOYSA-N	[CH2]Br
6806866	CH2Cl	chloromethyl radical	InChI=1S/CH2Cl/c1-2/h1H2	WBLIXGSTEMXDSM-UHFFFAOYSA-N	[CH2]Cl
6806866	CH2Cl	chloromethyl radical	InChI=1S/CH2Cl/c1-2/h1H2	WBLIXGSTEMXDSM-UHFFFAOYSA-N	[CH2]Cl
74839	CH3Br	methyl bromide	InChI=1S/CH3Br/c1-2/h1H3	GZUXJHMPEANEGY-UHFFFAOYSA-N	CBr		Embafume; Halon 1001; Methane, bromo-; Curafume; Monobromomethane; Methylbromid; Bromomethane
13465731	SiH3Br	bromosilane	InChI=1S/BrH3Si/c1-2/h2H3	VQPFDLRNOCQMSN-UHFFFAOYSA-N	[SiH3]Br		monobromosilane
12333572	SbN	Antimony nitride	InChI=1S/N.Sb		[Sb][N]
19952126	SbCl	Antimony monochloride	InChI=1S/ClH.Sb/h1H;/q;+1/p-1		[Sb]Cl		Antimony Chloride
25285727	SbF	Antimony monofluoride	InChI=1S/FH.Sb/h1H;/q;+1/p-1		[Sb]F		Antimony fluoride
13451177	TeO	Tellurium monoxide	InChI=1S/OTe/c1-2	QGMWCJPYHVWVRR-UHFFFAOYSA-N	[Te]=O
10028167	Te2	Tellurium diatomic	InChI=1S/Te2/c1-2	JPIIVHIVGGOMMV-UHFFFAOYSA-N	[Te]=[Te]		Ditellurium
10377512	LiI	Lithium Iodide	InChI=1S/HI.Li/h1H;/q;+1/p-1	HSZCZNFXUDYRKD-UHFFFAOYSA-M	[Li]I
7681825	NaI	Sodium Iodide	InChI=1S/HI.Na/h1H;/q;+1/p-1	FVAUCKIRQBBSSJ-UHFFFAOYSA-M	[Na]I
7681110	KI	Potassium Iodide	InChI=1S/HI.K/h1H;/q;+1/p-1	NLKNQRATVPKPDG-UHFFFAOYSA-M	[K]I
7553562	I2	Iodine diatomic	InChI=1S/I2/c1-2	PNDPGZBMCMUPRI-UHFFFAOYSA-N	II
7553562	I2+	Iodine diatomic cation	InChI=1S/I2/c1-2/q+1	GWDXVHOURQOCIJ-UHFFFAOYSA-N	I[I+]
7790990	ICl	Iodine monochloride	InChI=1S/ClI/c1-2	QZRGKCOWNLSUDK-UHFFFAOYSA-N	ICl
7789335	IBr	Iodine monobromide	InChI=1S/BrI/c1-2	CBEQRNSPHCCXSH-UHFFFAOYSA-N	IBr
29977411	AlI	Aluminum monoiodide	InChI=1S/Al.HI/h;1H/q+1;/p-1		[Al]I
14696981	IO	Iodine monoxide	InChI=1S/IO/c1-2	AFSVSXMRDKPOEW-UHFFFAOYSA-N	I[O]		Iodine oxide
13873842	IF	Iodine monofluoride	InChI=1S/FI/c1-2	PDJAZCSYYQODQF-UHFFFAOYSA-N	IF
14332219	HOI	Hypoiodous acid	InChI=1S/HIO/c1-2/h2H	GEOVEUCEIQCBKH-UHFFFAOYSA-N	OI
13598420	SiH3I	Silyl Iodide	InChI=1S/H3ISi/c1-2/h2H3	IDIOJRGTRFRIJL-UHFFFAOYSA-N	[SiH3]I		Iodosilane
74884	CH3I	methyl iodide	InChI=1S/CH3I/c1-2/h1H3	INQOMBQAUSQDDS-UHFFFAOYSA-N	CI		Methane, iodo-; Iodomethane; Halon 10001; Monoiodomethane
12596473	Li3	Lithium trimer	InChI=1S/3Li	FUXWSNBUHAEWQU-UHFFFAOYSA-N	[Li][Li][Li]
12596473	Li3+	Lithium trimer cation	InChI=1S/3Li/q;;+1	QYWCDVKQVLEPEA-UHFFFAOYSA-N	[Li+]1[Li][Li]1
12075353	C3	carbon trimer	InChI=1S/C3/c1-3-2	NVLRFXKSQQPKAD-UHFFFAOYSA-N	[C]=C=[C]
12075353	C3	carbon trimer	InChI=1S/C3/c1-3-2	NVLRFXKSQQPKAD-UHFFFAOYSA-N	[C]=C=[C]
12075353	C3+	carbon trimer cation	InChI=1S/C3/c1-3-2/q+1	PNCCOGRYBZMOKI-UHFFFAOYSA-N	[C]=[C+]=[C]
12075353	C3+	carbon trimer cation	InChI=1S/C3/c1-3-2/q+1	PNCCOGRYBZMOKI-UHFFFAOYSA-N	[C]=[C+]=[C]
9000220	C3H3	cyclopropenyl radical	InChI=1S/C3H3/c1-2-3-1/h1-3H	UKPXULFIISGBHG-UHFFFAOYSA-N	[CH]1C=C1
9000220	C3H3+	cyclopropenyl cation	InChI=1S/C3H3/c1-2-3-1/h1-3H/q+1	IPKCFGQXHZKYLH-UHFFFAOYSA-N	C1=C[CH+]1
2932787	C3H3-	Propargyl anion	InChI=1S/C3H3/c1-3-2/h1H,2H2/q-1	XPVBHDCWRJTAOG-UHFFFAOYSA-N	C#C[CH2-]
2932787	C3H3-	Propargyl anion	InChI=1S/C3H3/c1-3-2/h1H,2H2/q-1	XPVBHDCWRJTAOG-UHFFFAOYSA-N	C#C[CH2-]
2932787	C3H3	Propargyl radical	InChI=1S/C3H3/c1-3-2/h1H,2H2	DITHIFQMPPCBCU-UHFFFAOYSA-N	C#C[CH2]		Prop-1-yn-3-yl radical; Propargyl radical; propargyl
2932787	C3H3+	Propargyl cation	InChI=1S/C3H3/c1-3-2/h1H,2H2/q+1	XWSPZAXIQPESSO-UHFFFAOYSA-N	C#C[CH2+]
2781853	C3H4	cyclopropene	InChI=1S/C3H4/c1-2-3-1/h1-2H,3H2	OOXWYYGXTJLWHA-UHFFFAOYSA-N	C1=CC1		Cyclopropene
74997	CH3CCH	propyne	InChI=1S/C3H4/c1-3-2/h1H,2H3	MWWATHDPGQKSAR-UHFFFAOYSA-N	CC#C		1-Propyne; Acetylene, methyl-; Allylene; Methylacetylene; Propine; Propyne; prop-1-yne
463490	CH2CCH2	allene	InChI=1S/C3H4/c1-3-2/h1-2H2	IYABWNGZIDDRAK-UHFFFAOYSA-N	C=C=C		1,2-Propadiene; Allene; Dimethylenemethane; Propa-1,2-diene; Propadiene; Propadiene, inhibited; sym-Allylene
6067681	CH3CHCH	1-propenyl radical	InChI=1S/C3H5/c1-3-2/h1,3H,2H3	ZLRGTQBGRLOXCT-UHFFFAOYSA-N	[CH]=CC
1981802	C3H5	Allyl radical	InChI=1S/C3H5/c1-3-2/h3H,1-2H2	RMRFFCXPLWYOOY-UHFFFAOYSA-N	C=C[CH2]		Allyl radical; allyl
1981802	C3H5	Allyl radical	InChI=1S/C3H5/c1-3-2/h3H,1-2H2	RMRFFCXPLWYOOY-UHFFFAOYSA-N	C=C[CH2]		Allyl radical; allyl
1981802	C3H5+	Allyl cation	InChI=1S/C3H5/c1-3-2/h3H,1-2H2/q+1	WPKVKNZNPQRHOD-UHFFFAOYSA-N	C=C[CH2+]
115071	CH2CHCH3	Propene	InChI=1S/C3H6/c1-3-2/h3H,1H2,2H3	QQONPFPTGQHPMA-UHFFFAOYSA-N	C=CC		1-Propene; 1-Propylene; Methylethene; Methylethylene; Propene; Propylene; prop-1-ene
75194	C3H6	Cyclopropane	InChI=1S/C3H6/c1-2-3-1/h1-3H2	LVZWSLJZHVFIQJ-UHFFFAOYSA-N	C1CC1		Cyclopropane; Trimethylene; Trimethylene (cyclic)
2025550	CH3CHCH3	Isopropyl radical	InChI=1S/C3H7/c1-3-2/h3H,1-2H3	HNUALPPJLMYHDK-UHFFFAOYSA-N	C[CH]C		iso-C3H7; Isopropyl radical; propyl; propan-2-yl
2025550	CH3CHCH3+	Isopropyl cation	InChI=1S/C3H7/c1-3-2/h3H,1-2H3/q+1	MONCCXHJSVPFQF-UHFFFAOYSA-N	C[CH+]C		prop-2-yl cation; Isopropylium; 1-Methylethylium; 2-Propyl cation; 2-Propylium
2143615	C3H7	n-Propyl radical	InChI=1S/C3H7/c1-3-2/h1,3H2,2H3	OCBFFGCSTGGPSQ-UHFFFAOYSA-N	[CH2]CC		n-C3H7; n-Propyl radical; propyl; propan-1-yl
9000920	C3H7+	cyclopropane, protonated	InChI=1S/C3H7/c1-2-3-1/h1-2H2,3H3/q+1		C1C[CH3+]1		n-propyl cation
74986	C3H8	Propane	InChI=1S/C3H8/c1-3-2/h3H2,1-2H3	ATUOYWHBWRKTHZ-UHFFFAOYSA-N	CCC		Dimethylmethane; Freon 290; Liquefied petroleum gas; Lpg; n-Propane; Propane; Propyl hydride; R 290
2408368	LiCN	lithium cyanide	InChI=1S/CN.Li/c1-2;	KRPAPDCTWMTYHU-UHFFFAOYSA-N	[Li]C#N
2408368	LiCN	lithium cyanide	InChI=1S/CN.Li/c1-2;	KRPAPDCTWMTYHU-UHFFFAOYSA-N	[Li]C#N
2408368	LiCN	lithium cyanide	InChI=1S/CN.Li/c1-2;	KRPAPDCTWMTYHU-UHFFFAOYSA-N	[C]#[N][Li]
2468817	CNN	Diazocarbene	InChI=1S/CN2/c1-3-2	QDZARNQKIZUXDK-UHFFFAOYSA-N	[C]=[N+]=[N-]
1884646	NCN	Cyanoimidogen	InChI=1S/CN2/c2-1-3	NFKMPKOGCRBAJF-UHFFFAOYSA-N	[N]=C=[N]		Cyanonitrene
12596600	N3-	azide anion	InChI=1S/N3/c1-3-2/q-1	IVRMZWNICZWHMI-UHFFFAOYSA-N	[N][N-][N]		azide
12596600	N3	azide radical	InChI=1S/N3/c1-3-2	DUAJIKVIRGATIW-UHFFFAOYSA-N	[N]=[N+]=[N-]
12596600	N3+	azide cation	InChI=1S/N3/c1-3-2/q+1	QGBUGMRRICCMFI-UHFFFAOYSA-N	[N]=[N+]=[N]
253308702	CN2	3H-Diazirin-3-ylidene	InChI=1S/CN2/c1-2-3-1	NHKSYIUFCMYMCT-UHFFFAOYSA-N	[C]1N=N1
7782798	HN3	hydrogen azide	InChI=1S/HN3/c1-3-2/h1H	JUINSXZKUKVTMD-UHFFFAOYSA-N	N=[N+]=[N-]		hydrozoic acid; azoimide; diazoimide; triazoic acid; hydronitric acid; hydrogen azide
7782798	HN3+	Hydrazoic acid cation	InChI=1S/HN3/c1-3-2/h1H/q+1		[NH][N+]#N		Hydrazoic acid radical cation
20813325	HCNN	diazomethyl radical	InChI=1S/CHN2/c1-3-2/h1H		[CH]=[N+]=[N-]		Diazomethyl
2612626	HCCN	cyanomethylene	InChI=1S/C2HN/c1-2-3/h1H	SZICEGNEOSKVLO-UHFFFAOYSA-N	[CH]C#N
2612626	HCCN	cyanomethylene	InChI=1S/C2HN/c1-2-3/h1H	SZICEGNEOSKVLO-UHFFFAOYSA-N	[CH]C#N
151519	HNCNH	diiminomethane	InChI=1S/CH2N2/c2-1-3/h2-3H	VPKDCDLSJZCGKE-UHFFFAOYSA-N	N=C=N
157222	CH2N2	diazirine	InChI=1S/CH2N2/c1-2-3-1/h1H2	GKVDXUXIAHWQIK-UHFFFAOYSA-N	N1N=C1		3H-Diazirine
420042	NH2CN	cyanamide	InChI=1S/CH2N2/c2-1-3/h2H2	XZMCDFZZKTWFGF-UHFFFAOYSA-N	NC#N		carbamonitrile; Amidocyanogen; Carbimide; Cyanoamine; Cyanogen nitride; Cyanogenamide; Hydrogen cyanamide; cyanamide
420042	NH2CN	cyanamide	InChI=1S/CH2N2/c2-1-3/h2H2	XZMCDFZZKTWFGF-UHFFFAOYSA-N	NC#N		carbamonitrile; Amidocyanogen; Carbimide; Cyanoamine; Cyanogen nitride; Cyanogenamide; Hydrogen cyanamide; cyanamide
334883	CH2NN	diazomethane	InChI=1S/CH2N2/c1-3-2/h1H2	YXHKONLOYHBTNS-UHFFFAOYSA-N	C=[N+]=[N-]
43422908	NH2NN+	hydrazoic acid, protonated	InChI=1S/H2N3/c1-3-2/h1H2/q+1		N[N+]#N		Diazonium, amino-; Aminodiazonium
950477813	HNNNH+	1,2-Triazadienium	InChI=1S/H2N3/c1-3-2/h1-2H/q+1		N=[N+]=N		hydrozoic acid, protonated
53768404	NH2CNH+	cyanamide, cn protonated	InChI=1S/CH2N2/c2-1-3/h2H2/p+1		[NH+]#CN
52324046	HCCNH2	Ethynamine	InChI=1S/C2H3N/c1-2-3/h1H,3H2		C#CN
88333022	H2CNCH	methyleneaminomethylene	InChI=1S/C2H3N/c1-3-2/h1H,2H2		C=N[CH]
17619226	H2CCNH	Ethenimine	InChI=1S/C2H3N/c1-2-3/h3H,1H2	ZUKSLMGYYPZZJD-UHFFFAOYSA-N	C=C=N
9000922	NH3CN+	cyanamide, amine protonated	InChI=1S/CH2N2/c2-1-3/h2H2/p+1		[NH3+]C#N
9000800	NCNH3+	Cyanamide, protonated	InChI=1S/CH2N2/c2-1-3/h2H2/p+1	XZMCDFZZKTWFGF-UHFFFAOYSA-O	N#C[NH3+]
9000801	HNCNH2+	diiminomethane, protonated	InChI=1S/CH2N2/c2-1-3/h2-3H/p+1	VPKDCDLSJZCGKE-UHFFFAOYSA-O	N=C=[NH2+]
157164	CHNCH2	2H-Azirine	InChI=1S/C2H3N/c1-2-3-1/h1H,2H2	NTJMGOWFGQXUDY-UHFFFAOYSA-N	N1=CC1
157164	HCNCH2+	2H-Azirine cation	InChI=1S/C2H3N/c1-2-3-1/h1H,2H2/q+1		[N+]1=CC1
157175	CHNHCH	1H-Azirine	InChI=1S/C2H3N/c1-2-3-1/h1-3H	ZHKJHQBOAJQXQR-UHFFFAOYSA-N	N1C=C1
75058	CH3CN-	acetonitrile anion	InChI=1S/C2H3N/c1-2-3/h1H3/q-1	WPBBMPWLVTVFOO-UHFFFAOYSA-N	[CH3-]C#N
75058	CH3CN-	acetonitrile anion	InChI=1S/C2H3N/c1-2-3/h1H3/q-1	WPBBMPWLVTVFOO-UHFFFAOYSA-N	[CH3-]C#N
75058	CH3CN	Acetonitrile	InChI=1S/C2H3N/c1-2-3/h1H3	WEVYAHXRMPXWCK-UHFFFAOYSA-N	CC#N		Acetonitril; Acetonitrile; Cyanomethane; Cyanure de methyl; Ethanenitrile; Ethyl nitrile; Methane, cyano-; Methanecarbonitrile; Methyl cyanide; Methylkyanid; NA 1648; USAF ek-488
75058	CH3CN+	Acetonitrile cation	InChI=1S/C2H3N/c1-2-3/h1H3/q+1	BARVRYCKQQYPDL-UHFFFAOYSA-N	C[C]#[N+]
75058	CH3CN+	Acetonitrile cation	InChI=1S/C2H3N/c1-2-3/h1H3/q+1	BARVRYCKQQYPDL-UHFFFAOYSA-N	C[C]#[N+]
593759	CH3NC	methyl isocyanide	InChI=1S/C2H3N/c1-3-2/h1H3	ZRKSVHFXTRFQFL-UHFFFAOYSA-N	C[N+]#[C-]		Methane, isocyano-; isocyanomethane; Methyl isonitrile
10000	NHCHNH2	aminomethanimine	InChI=1S/CH4N2/c2-1-3/h1H,(H3,2,3)	PNKUSGQVOMIXLU-UHFFFAOYSA-N	NC=N
28445332	CH3CHN	methylmethaniminyl radical	InChI=1S/C2H4N/c1-2-3/h2H,1H3	IBGMUOPBPGVUMD-UHFFFAOYSA-N	CC=[N]
50614034	CH2CHNH	vinylazine	InChI=1S/C2H4N/c1-2-3/h2-3H,1H2	NWMFLNMQDRCAOB-UHFFFAOYSA-N	C=C[NH]		vinyl-@lambda;2-azane; 2@lambda;3-ethan-1-imine
50614034	CH2CHNH	vinylazine	InChI=1S/C2H4N/c1-2-3/h2-3H,1H2	NWMFLNMQDRCAOB-UHFFFAOYSA-N	C=C[NH]		vinyl-@lambda;2-azane; 2@lambda;3-ethan-1-imine
18447535	NH2BHNH2	diaminoborane	InChI=1S/BH5N2/c2-1-3/h1H,2-3H2		NBN		Borane, diamino-
20729413	CH3CHNH	ethanimine	InChI=1S/C2H5N/c1-2-3/h2-3H,1H3	MPAYEWNVIPXRDP-UHFFFAOYSA-N	CC=N		Acetaldimine; ethanimine
20729413	CH3CHNH	ethanimine	InChI=1S/C2H5N/c1-2-3/h2-3H,1H3	MPAYEWNVIPXRDP-UHFFFAOYSA-N	CC=N		Acetaldimine; ethanimine
151564	C2H5N	Aziridine	InChI=1S/C2H5N/c1-2-3-1/h3H,1-2H2	NOWKCMXCCJGMRR-UHFFFAOYSA-N	N1CC1		1H-Azirine, dihydro-; Aethylenimin; Aminoethylene; Azacyclopropane; Aziran; Azirane; Aziridin; Aziridine; Dihydro-1H-azirine; Dihydroazirene; Dimethyleneimine; Dimethylenimine; EI; ENT-50324; Ethirydine; Ethyleenimine; Ethylene imine, inhibited; Ethyleneimine; Ethylenimine; Ethylimine; Etilenimina; TL 337
593679	CH2CHNH2	aminoethene	InChI=1S/C2H5N/c1-2-3/h2H,1,3H2	UYMKPFRHYYNDTL-UHFFFAOYSA-N	C=CN		Vinylamine; Aminoethylene; Ethenamine; Ethylenamine; Ethyleneamine
1761677	CH2NCH3	N-methylmethanimine	InChI=1S/C2H5N/c1-3-2/h1H2,2H3	NYVSDPNXBIEFPW-UHFFFAOYSA-N	C=NC		2-Azapropene; N-methylenemethanamine
2372885	NH2CH2NH2	diaminomethane	InChI=1S/CH6N2/c2-1-3/h1-3H2	RTWNYYOXLSILQN-UHFFFAOYSA-N	NCN
2372885	NH2CH2NH2	diaminomethane	InChI=1S/CH6N2/c2-1-3/h1-3H2	RTWNYYOXLSILQN-UHFFFAOYSA-N	NCN
9000909	C2H5NH+	Protonated Aziridine	InChI=1S/C2H5N/c1-2-3-1/h3H,1-2H2/p+1	NOWKCMXCCJGMRR-UHFFFAOYSA-O	[NH2+]1CC1
9000916	C2H6N+	aziridine, protonated	InChI=1S/C2H5N/c1-2-3-1/h3H,1-2H2/p+1		[NH2+]1CC1
62901706	NH2CH2NH3+	diaminoethane, protonated	InChI=1S/CH6N2/c2-1-3/h1-3H2/p+1		NC[NH3+]
124403	CH3NHCH3	Dimethylamine	InChI=1S/C2H7N/c1-3-2/h3H,1-2H3	ROSDSFDQCJNGOL-UHFFFAOYSA-N	CNC		Dimethylamine; DMA; Methanamine, N-methyl-; N-Methylmethanamine
75047	CH3CH2NH2	Ethylamine	InChI=1S/C2H7N/c1-2-3/h2-3H2,1H3	QUSNBJAOOMFDIB-UHFFFAOYSA-N	CCN		1-Aminoethane; Aethylamine; Aminoethane; Ethanamine; Ethylamine; Etilamina; Etyloamina; Monoethylamine
75047	CH3CH2NH2	Ethylamine	InChI=1S/C2H7N/c1-2-3/h2-3H2,1H3		CCN		1-Aminoethane; Aethylamine; Aminoethane; Ethanamine; Ethylamine; Etilamina; Etyloamina; Monoethylamine
848779204	CH3CH2NH3+	ethylamine, protonated	InChI=1S/C2H7N/c1-2-3/h2-3H2,1H3/p+1	QUSNBJAOOMFDIB-UHFFFAOYSA-O	[NH3+]CC		ethylammonium cation
145384527	(CH3)2NH2+	dimethylammonium cation	InChI=1S/C2H7N/c1-3-2/h3H,1-2H3/p+1	ROSDSFDQCJNGOL-UHFFFAOYSA-O	C[NH2+]C		Dimethyl amine, protonated
124389	CO2-	Carbon dioxide anion	InChI=1S/CO2/c2-1-3/q-1	SSODQXRGMVULMF-UHFFFAOYSA-N	O=[C-][O]
124389	CO2-	Carbon dioxide anion	InChI=1S/CO2/c2-1-3/q-1	SSODQXRGMVULMF-UHFFFAOYSA-N	O=[C-][O]
124389	CO2	Carbon dioxide	InChI=1S/CO2/c2-1-3	CURLTUGMZLYLDI-UHFFFAOYSA-N	O=C=O		Anhydride carbonique; Carbon dioxide; Carbon oxide (CO2); Carbonic acid, gas; Carbonic anhydride; Carbonice; Dry ice; Kohlendioxyd; Kohlensaure
124389	CO2+	Carbon dioxide cation	InChI=1S/CO2/c2-1-3/q+1	PCDPTONYKSNEJX-UHFFFAOYSA-N	[O][C+]=O
124389	CO2+	Carbon dioxide cation	InChI=1S/CO2/c2-1-3/q+1	PCDPTONYKSNEJX-UHFFFAOYSA-N	[O][C+]=O
82267150	CNO-	fulminate	InChI=1S/CHNO/c1-2-3/h3H/p-1	OTXBWGUYZNKPMG-UHFFFAOYSA-M	[C]=N[O-]
82267150	CNO-	fulminate	InChI=1S/CNO/c1-2-3/q-1	USXDFAGDIOXNML-UHFFFAOYSA-N	[O-][N+]#[C-]
22400266	NCO-	cyanate	InChI=1S/CHNO/c2-1-3/h3H/p-1	XLJMAIOERFSOGZ-UHFFFAOYSA-M	N#C[O-]		cyanate; isocyanate; cyanato anion; isocyanato anion
22400266	NCO	isocyanato radical	InChI=1S/CNO/c2-1-3	HKKDKUMUWRTAIA-UHFFFAOYSA-N	[N]=C=O
13840885	BO2-	Boron dioxide anion	InChI=1S/BO2/c2-1-3/q-1	VDLZIANVOYDKFH-UHFFFAOYSA-N	O=[B-]=O
13840885	BO2-	Boron dioxide anion	InChI=1S/BO2/c2-1-3/q-1	VDLZIANVOYDKFH-UHFFFAOYSA-N	[O-]B=O
13840885	BO2	Boron dioxide	InChI=1S/BO2/c2-1-3	IBNAUDPYZAZFLM-UHFFFAOYSA-N	O=B=O		Boron oxide
13840885	BO2+	Boron dioxide cation	InChI=1S/BO2/c2-1-3/q+1	ZVMRFIDMDQSHBG-UHFFFAOYSA-N	[O][B+][O]
12071237	CCO	Dicarbon monoxide	InChI=1S/C2O/c1-2-3	VILAVOFMIJHSJA-UHFFFAOYSA-N	[C]=C=O
12136560	LiO2	Lithium dioxide	InChI=1S/Li.2O		[O][Li][O]		Lithium Superoxide
12057248	Li2O	dilithium oxide	InChI=1S/2Li.O	XZIUWXMPQBQHMC-UHFFFAOYSA-N	[Li]O[Li]		lithium oxide
12057248	Li2O	dilithium oxide	InChI=1/2Li.O/rLi2O/c1-3-2	XZIUWXMPQBQHMC-GBJCHMORNA-N	[Li]O[Li]		lithium oxide
12057248	Li2O+	dilithium oxide cation	InChI=1S/2Li.O/q;+1;	YLMIOLAGPPQQMI-UHFFFAOYSA-N	[Li][O+][Li]
12057248	Li2O+	dilithium oxide cation	InChI=1/2Li.O/q;+1;/rLi2O/c1-3-2/q+1	YLMIOLAGPPQQMI-AKZOVUJHNA-N	[Li][O+][Li]
10102440	NO2-	Nitrogen dioxide anion	InChI=1S/HNO2/c2-1-3/h(H,2,3)/p-1	IOVCWXUNBOPUCH-UHFFFAOYSA-M	[O-]N=O		nitrite
10102440	NO2	Nitrogen dioxide	InChI=1S/NO2/c2-1-3	JCXJVPUVTGWSNB-UHFFFAOYSA-N	O=N=O		Azote; Azoto; NA 1067; Nitrito; Nitro; Nitrogen dioxide; Nitrogen oxide; Nitrogen oxide (NO2); Nitrogen peroxide; Stickstoffdioxid; Stikstofdioxyde
10102440	NO2+	Nitrogen dioxide cation	InChI=1S/NO2/c2-1-3/q+1	OMBRFUXPXNIUCZ-UHFFFAOYSA-N	O=[N+]=O		nitronium
10024972	N2O-	Nitrous oxide anion	InChI=1S/N2O/c1-2-3/q-1	NLBWPJGNGYHCQO-UHFFFAOYSA-N	[N-]N=O
10024972	N2O-	Nitrous oxide anion	InChI=1S/HN2O/c1-2-3/h3H/p-1	MLBDTVVZLMQMLJ-UHFFFAOYSA-M	[O-]N=[N]
10024972	N2O	Nitrous oxide	InChI=1S/N2O/c1-2-3	GQPLMRYTRLFLPF-UHFFFAOYSA-N	[N]N=O		Dinitrogen monoxide; Dinitrogen oxide; Factitious air; Hyponitrous acid anhydride; Laughing gas; Nitrogen Monoxide; Nitrogen oxide; Nitrogen oxide (N2O); Nitrous Oxide
10024972	N2O+	Nitrous oxide cation	InChI=1S/N2O/c1-2-3/q+1	BEZCXZPDDIVIRI-UHFFFAOYSA-N	[N]=[N+]=O
10028156	O3-	Ozone anion	InChI=1S/O3/c1-3-2/q-1	QOHPWKJMIUDENU-UHFFFAOYSA-N	[O]O[O-]		ozonide; Trioxidan-1-id-3-yl
10028156	O3-	Ozone anion	InChI=1S/O3/c1-3-2/q-1	QOHPWKJMIUDENU-UHFFFAOYSA-N	[O]O[O-]		ozonide; Trioxidan-1-id-3-yl
10028156	O3	Ozone	InChI=1S/O3/c1-3-2	CBENFWSGALASAD-UHFFFAOYSA-N	O=[O+][O-]		Ozon; Ozone; Triatomic oxygen; trioxidane
10028156	O3+	Ozone cation	InChI=1S/O3/c1-3-2/q+1	GBTYLRHVJVWXAA-UHFFFAOYSA-N	[O][O+]=O
12500786	O3H+	protonated ozone	InChI=1S/HO3/c1-3-2/h1H/q+1	FQWSHTCXTQFHJZ-UHFFFAOYSA-N	O[O+]=O
12500786	O3H+	protonated ozone	InChI=1S/HO3/c1-3-2/h1H/q+1	FQWSHTCXTQFHJZ-UHFFFAOYSA-N	O[O+]=O
12311976	HCO2-	formate anion	InChI=1S/CH2O2/c2-1-3/h1H,(H,2,3)/p-1	BDAGIHXWWSANSR-UHFFFAOYSA-M	O=C[O-]
9000392	HCOO	formate neutral radical	InChI=1S/CHO2/c2-1-3/h1H	JRCLCXAVSVCEQC-UHFFFAOYSA-N	O=C[O]
7782776	HNO2	Nitrous acid	InChI=1S/HNO2/c2-1-3/h(H,2,3)	IOVCWXUNBOPUCH-UHFFFAOYSA-N	ON=O		Kyselina dusite; Nitrosyl hydroxide; Nitrous acid; Nitrous acid, trans
7782776	HNO2+	nitrous acid cation	InChI=1S/HNO2/c2-1-3/h1H/q+1	SDANASVQBIOOQZ-UHFFFAOYSA-N	[O][NH+][O]
76412549	NNOH+	Nitrous Oxide, O-protonated	InChI=1S/N2O/c1-2-3/p+1	GQPLMRYTRLFLPF-UHFFFAOYSA-O	N#[N+]O
107190772	HNNO	nitrosoazane	InChI=1S/HN2O/c1-2-3/h1H		[NH]N=O
107190772	HNNO+	Nitrous oxide, N-protonated	InChI=1S/HN2O/c1-2-3/h1H/q+1	IMYMYABFOBYCQP-UHFFFAOYSA-N	N=[N+]=O
107190772	HNNO+	Nitrous oxide, N-protonated	InChI=1S/HN2O/c1-2-3/h1H/q+1	IMYMYABFOBYCQP-UHFFFAOYSA-N	N=[N+]=O
51095159	HCCO	ketenyl radical	InChI=1S/C2HO/c1-2-3/h1H	QEJQAPYSVNHDJF-UHFFFAOYSA-N	[CH]=C=O		Ethynyloxy radical
51095159	HCCO	ketenyl radical	InChI=1S/C2HO/c1-2-3/h1H	QEJQAPYSVNHDJF-UHFFFAOYSA-N	[CH]=C=O		Ethynyloxy radical
420053	HOCN	cyanic acid	InChI=1S/CHNO/c2-1-3/h3H	XLJMAIOERFSOGZ-UHFFFAOYSA-N	OC#N
506854	HCNO	fulminic acid	InChI=1S/CHNO/c1-2-3/h1H	UXKUODQYLDZXDL-UHFFFAOYSA-N	O[N+]#[C-]		Hydrogen cyanide N-oxide
506854	HCNO	fulminic acid	InChI=1S/CHNO/c1-2-3/h1H	UXKUODQYLDZXDL-UHFFFAOYSA-N	O[N+]#[C-]		Hydrogen cyanide N-oxide
75138	HNCO	Isocyanic acid	InChI=1S/CHNO/c2-1-3/h2H	OWIKHYCFFJSOEH-UHFFFAOYSA-N	N=C=O		Carbimide; Hydrogen isocyanate; Isocyanic acid
2564865	HOCO	Hydrocarboxyl radical	InChI=1S/CHO2/c2-1-3/h(H,2,3)	ORTFAQDWJHRMNX-UHFFFAOYSA-N	O[C]=O
2564865	HOCO	Hydrocarboxyl radical	InChI=1S/CHO2/c2-1-3/h(H,2,3)	ORTFAQDWJHRMNX-UHFFFAOYSA-N	O[C]=O
2564865	HOCO+	Hydrocarboxyl cation	InChI=1S/CHO2/c2-1-3/h(H,2,3)/q+1	CLJFDRKGHKJAKZ-UHFFFAOYSA-N	O[C+]=O		protonated carbon dioxide; hydroxy(oxo)methylium
2564865	HOCO+	Hydrocarboxyl cation	InChI=1/CHO2/c2-1-3/h(H,2,3)/q+1/f/h2H	CLJFDRKGHKJAKZ-QEZKKOIZNA-N	O=C=[OH+]		protonated carbon dioxide; hydroxy(oxo)methylium
64186	HCOOH	Formic acid	InChI=1S/CH2O2/c2-1-3/h1H,(H,2,3)	BDAGIHXWWSANSR-UHFFFAOYSA-N	OC=O		Acide formique; Acido formico; Add-F; Ameisensaeure; Aminic acid; Bilorin; Collo-Bueglatt; Collo-Didax; Formic acid; Formic acid, solution; Formira; Formisoton; Formylic acid; Hydrogen carboxylic acid; Kwas metaniowy; Kyselina mravenci; Methanoic acid; Mierenzuur; Myrmicyl
64186	HCOOH	Formic acid	InChI=1S/CH2O2/c2-1-3/h1H,(H,2,3)	BDAGIHXWWSANSR-UHFFFAOYSA-N	OC=O		Acide formique; Acido formico; Add-F; Ameisensaeure; Aminic acid; Bilorin; Collo-Bueglatt; Collo-Didax; Formic acid; Formic acid, solution; Formira; Formisoton; Formylic acid; Hydrogen carboxylic acid; Kwas metaniowy; Kyselina mravenci; Methanoic acid; Mierenzuur; Myrmicyl
463514	CH2CO	Ketene	InChI=1S/C2H2O/c1-2-3/h1H2	CCGKOQOJPYTBIH-UHFFFAOYSA-N	C=C=O		Carbomethene; Ethenone; Ketene; Keto-ethylene; Methylene ketene
463514	CH2CO+	Ketene cation	InChI=1S/C2H2O/c1-2-3/h1H2/q+1	UJTMLNARSPORHR-UHFFFAOYSA-N	C=C=[O+]
157186	C2H2O	Oxirene	InChI=1S/C2H2O/c1-2-3-1/h1-2H	BJEYNNFDAPPGST-UHFFFAOYSA-N	O1C=C1
157266	CH2O2	Dioxirane	InChI=1S/CH2O2/c1-2-3-1/h1H2	ASQQEOXYFGEFKQ-UHFFFAOYSA-N	O1OC1
56077920	H2COO	Dioxymethyl radical	InChI=1S/CH2O2/c1-3-2/h1H2		C=[O+][O-]		Criegee intermediate; Carbonyl oxide; Formaldehyde oxide; methylene peroxy
56077920	H2COO+	dioxymethyl cation	InChI=1S/CH2O2/c1-3-2/h1H2/q+1		C=[O+][O]		methylene peroxy cation
35576911	NH2NO	Nitrosamide	InChI=1S/H2N2O/c1-2-3/h(H2,1,3)	XKLJHFLUAHKGGU-UHFFFAOYSA-N	O=NN		Nitrosamine; N-​Nitrosamine; Nitrous amide; Nitroxylamide
32038792	HCCOH	ethynol	InChI=1S/C2H2O/c1-2-3/h1,3H	QFXZANXYUCUTQH-UHFFFAOYSA-N	C#CO
14699991	H2O3	Hydrogen trioxide	InChI=1S/H2O3/c1-3-2/h1-2H	JSPLKZUTYZBBKA-UHFFFAOYSA-N	OOO		trioxidane
13327327	Be(OH)2	Beryllium hydroxide	InChI=1S/Be.2H2O/h;2*1H2/q+2;;/p-2		O[Be]O
13327327	Be(OH)2	Beryllium hydroxide	InChI=1S/Be.2H2O/h;2*1H2/q+2;;/p-2		O[Be]O
13327327	Be(OH)2	Beryllium hydroxide	InChI=1S/Be.2H2O/h;2*1H2/q+2;;/p-2		O[Be]O
13205442	BH3CO	Borane carbonyl	InChI=1S/CH3BO/c2-1-3/h2H3	ZJUVLBOEAXFSHP-UHFFFAOYSA-N	[BH3-][C]=[O+]
9000777	HOCHNH	hydroxymethylimine	InChI=1S/CH3NO/c2-1-3/h1H,(H2,2,3)	ZHNUHDYFZUAESO-UHFFFAOYSA-N	OC=N
9000777	HOCHNH	hydroxymethylimine	InChI=1/CH3NO/c2-1-3/h1H,(H2,2,3)/f/h2-3H/b2-1+	ZHNUHDYFZUAESO-ZGLFGPHZNA-N	OC=N
9000777	HOCHNH	hydroxymethylimine	InChI=1S/CH3NO/c2-1-3/h1H,(H2,2,3)	ZHNUHDYFZUAESO-UHFFFAOYSA-N	OC=N
9000777	HOCHNH	hydroxymethylimine	InChI=1/CH3NO/c2-1-3/h1H,(H2,2,3)/f/h2-3H/b2-1+	ZHNUHDYFZUAESO-ZGLFGPHZNA-N	OC=N OC=N
9000777	HOCHNH	hydroxymethylimine	InChI=1S/CH3NO/c2-1-3/h1H,(H2,2,3)	ZHNUHDYFZUAESO-UHFFFAOYSA-N	OC=N
9000777	HOCHNH	hydroxymethylimine	InChI=1/CH3NO/c2-1-3/h1H,(H2,2,3)/f/h2-3H/b2-1-	ZHNUHDYFZUAESO-HEFLTZLYNA-N	OC=N
9000344	CH2OOH	CH2OOH radical	InChI=1S/CH3O2/c1-3-2/h2H,1H2	CIWKZUVHMBXKEZ-UHFFFAOYSA-N	[CH2]C=O
41084893	CH2COH+	ketene, protonated	InChI=1S/C2H2O/c1-2-3/h1H2/p+1		C=C=[OH+]
79723210	CH3BO	Borane, methyloxo-	InChI=1S/CH3BO/c1-2-3/h1H3	UYVGUZKUXWFNRX-UHFFFAOYSA-N	CB=O		Methyl(oxo)borane
75172	CH2NOH	formaldoxime	InChI=1S/CH3NO/c1-2-3/h3H,1H2	SQDFHQJTAWCFIB-UHFFFAOYSA-N	C=NO		formaldehyde oxime
75127	CHONH2	formamide	InChI=1S/CH3NO/c2-1-3/h1H,(H2,2,3)	ZHNUHDYFZUAESO-UHFFFAOYSA-N	NC=O		Amid kyseliny mravenci; Formimidic acid; formamide; Methanamide; Carbamaldehyde
75127	CHONH2	formamide	InChI=1/CH3NO/c2-1-3/h1H,(H2,2,3)/f/h2H2	ZHNUHDYFZUAESO-RZDQGJFANA-N	NC=O		Amid kyseliny mravenci; Formimidic acid; formamide; Methanamide; Carbamaldehyde
75127	CHONH2	formamide	InChI=1S/CH3NO/c2-1-3/h1H,(H2,2,3)	ZHNUHDYFZUAESO-UHFFFAOYSA-N	NC=O		Amid kyseliny mravenci; Formimidic acid; formamide; Methanamide; Carbamaldehyde
2143580	CH3OO-	methylperoxy anion	InChI=1S/CH4O2/c1-3-2/h2H,1H3/p-1	MEUKEBNAABNAEX-UHFFFAOYSA-M	CO[O-]
2143580	CH3OO-	methylperoxy anion	InChI=1/CH4O2/c1-3-2/h2H,1H3/p-1/fCH3O2/h2h/q-1	MEUKEBNAABNAEX-ZAIKRNDUNA-M	CO[O-]
2143580	CH3OO-	methylperoxy anion	InChI=1S/CH4O2/c1-3-2/h2H,1H3/p-1	MEUKEBNAABNAEX-UHFFFAOYSA-M	CO[O-]
2143580	CH3OO	methylperoxy radical	InChI=1S/CH3O2/c1-3-2/h1H3	WTFNSXYULBQCQV-UHFFFAOYSA-N	CO[O]		peroxymethyl; methylperoxy
2143580	CH3OO+	methylperoxy cation	InChI=1S/CH3O2/c1-3-2/h1H3/q+1	HRUCYOXWRHWOMG-UHFFFAOYSA-N	C[O+]=O
2143580	CH3OO+	methylperoxy cation	InChI=1S/CH3O2/c1-3-2/h1H3/q+1	HRUCYOXWRHWOMG-UHFFFAOYSA-N	C[O+]=O
3170692	CH3CO-	Acetyl anion	InChI=1S/C2H3O/c1-2-3/h1H3/q-1	RRGZOQKPWJKLOE-UHFFFAOYSA-N	C[C-][O]
3170692	CH3CO	Acetyl radical	InChI=1S/C2H3O/c1-2-3/h1H3	TUCNEACPLKLKNU-UHFFFAOYSA-N	O=[C]C		Acetyl radical; acetyl
3170692	CH3CO+	acetyl cation	InChI=1S/C2H3O/c1-2-3/h1H3/q+1	TWAOQVMPIYQPKG-UHFFFAOYSA-N	O=[C+]C
6827265	CNOH3	1,2-oxaziridine	InChI=1S/CH3NO/c1-2-3-1/h2H,1H2	SJGALSBBFTYSBA-UHFFFAOYSA-N	C1NO1
4400015	CH2CHO	Vinyloxy radical	InChI=1S/C2H3O/c1-2-3/h2H,1H2	FATAVLOOLIRUNA-UHFFFAOYSA-N	[CH2]C=O
865407	CH3NO	nitrosomethane	InChI=1S/CH3NO/c1-2-3/h1H3	IMHRONYAKYWGCC-UHFFFAOYSA-N	CN=O
422506716	CH2BOH	hydroxy(methylene)borane	InChI=1S/CH3BO/c1-2-3/h3H,1H2	CZEUABRGABCIIL-UHFFFAOYSA-N	C=BO
557755	CH2CHOH	ethenol	InChI=1S/C2H4O/c1-2-3/h2-3H,1H2	IMROMDMJAWUWLK-UHFFFAOYSA-N	C=CO		Vinyl alcohol; Hydroxyethylene; ethenol
3031730	CH3OOH	Methyl peroxide	InChI=1S/CH4O2/c1-3-2/h2H,1H3	MEUKEBNAABNAEX-UHFFFAOYSA-N	OOC		Hydroperoxide, methyl; methyl Hydroperoxide; hydroperoxymethane
75070	CH3CHO	Acetaldehyde	InChI=1S/C2H4O/c1-2-3/h2H,1H3	IKHGUXGNUITLKF-UHFFFAOYSA-N	CC=O		Acetaldehyd; Acetaldehyde; Acetaldeyde; Acetic aldehyde; Acetylaldehyde; Aldehyde acetique; Aldeide acetica; Ethanal; Ethyl aldehyde; Octowy aldehyd
75070	CH3CHO+	acetaldehyde cation	InChI=1S/C2H4O/c1-2-3/h2H,1H3/q+1		C[CH+][O]
75218	C2H4O	Ethylene oxide	InChI=1S/C2H4O/c1-2-3-1/h1-2H2	IAYPIBMASNFSPL-UHFFFAOYSA-N	C1CO1		α,β-Oxidoethane; 1,2-Epoxyethane; Dihydrooxirene; Dimethylene oxide; E.O.; Epoxyethane; Ethene oxide; Oxacyclopropane; Oxirane; Oxirene, Dihydro-; alpha,beta-Oxidoethane
75218	C2H4O+	ethylene oxide cation	InChI=1S/C2H4O/c1-2-3-1/h1-2H2/q+1		[O+]1CC1
55	H2OH2CO	water formaldehyde dimer	InChI=1S/CH3O.H2O/c1-2;/h2H,1H2;1H2	WYLNZMAZETZTPE-UHFFFAOYSA-N	O.C=O
463570	CH2(OH)2	methanediol	InChI=1S/CH4O2/c2-1-3/h2-3H,1H2	CKFGINPQOCXMAZ-UHFFFAOYSA-N	OCO		methylene glycol
74427284	H2COCH2+	Methyl, (methyleneoxoniumyl)-	InChI=1S/C2H4O/c1-3-2/h1-2H2/q+1		[CH2][O+]=C
50785803	NH2CHOH+	Formamide, O-protonated	InChI=1S/CH3NO/c2-1-3/h1H,(H2,2,3)/p+1		[OH+]=CN
9000924	NH3CHO+	Formamide, N-Protonated
9000770	H2CONH2+	protonated formamide	InChI=1S/CH3NO/c2-1-3/h1H,(H2,2,3)/p+1	ZHNUHDYFZUAESO-UHFFFAOYSA-O	OC=[NH2+]
9000770	H2CONH2+	protonated formamide	InChI=1S/CH4NO/c2-1-3/h1,3H,2H2/q+1	QUOAGGNJAZUPJG-UHFFFAOYSA-N	N[CH+]O
9000915	C2H4OH+	ethylene oxide, protonated	InChI=1S/C2H4O/c1-2-3-1/h1-2H2/p+1		[OH+]1CC1
16520040	CH3OCH2	methoxymethyl radical	InChI=1S/C2H5O/c1-3-2/h1H2,2H3	AFGPRWUFPLEMTF-UHFFFAOYSA-N	CO[CH2]
3088275	NH2CH2OH	aminomethanol	InChI=1S/CH5NO/c2-1-3/h3H,1-2H2	XMYQHJDBLRZMLW-UHFFFAOYSA-N	NCO		Carbinolamine; hydroxymethylamine
2154509	CH3CH2O	Ethoxy radical	InChI=1S/C2H5O/c1-2-3/h2H2,1H3	VOLGAXAGEUPBDM-UHFFFAOYSA-N	CC[O]
2348461	CH3CHOH	1-hydroxy-ethyl radical	InChI=1S/C2H5O/c1-2-3/h2-3H,1H3	GAWIXWVDTYZWAW-UHFFFAOYSA-N	C[CH]O		1-Hydroxyethyl; Hydroxyethyl radical; α-Hydroxyethyl
2348461	CH3CHOH+	acetaldehyde, protonated	InChI=1S/C2H5O/c1-2-3/h2-3H,1H3/q+1	GVWBHEKHFYAXOH-UHFFFAOYSA-N	C[CH+]O
2348461	CH3CHOH+	acetaldehyde, protonated	InChI=1S/C2H4O/c1-2-3/h2H,1H3/p+1	IKHGUXGNUITLKF-UHFFFAOYSA-O	CC=[OH+]
4422542	CH2CH2OH	2-hydroxy ethyl radical	InChI=1S/C2H5O/c1-2-3/h3H,1-2H2	HVFGPIFTSJJAKK-UHFFFAOYSA-N	OC[CH2]		ethanol-2-yl
4422542	CH2CH2OH	2-hydroxy ethyl radical	InChI=1S/C2H5O/c1-2-3/h3H,1-2H2	HVFGPIFTSJJAKK-UHFFFAOYSA-N	OC[CH2]		ethanol-2-yl
115106	CH3OCH3	Dimethyl ether	InChI=1S/C2H6O/c1-3-2/h1-2H3	LCGLNKUTAGEVQW-UHFFFAOYSA-N	COC		Dimethyl ether; Dimethyl oxide; Dymel A; Ether, dimethyl; Ether, methyl; Methane, oxybis-; Methoxymethane; Methyl ether; Oxybismethane; ether; Wood ether
77	H2OCH3OH	water methanol dimer	InChI=1S/CH4O.H2O/c1-2;/h2H,1H3;1H2	GBMDVOWEEQVZKZ-UHFFFAOYSA-N	OC.O
77	H2OCH3OH	water methanol dimer	InChI=1S/CH6O2/c1-3-4-2/h2-3H,1H3	NBQCBEISNPLSNO-UHFFFAOYSA-N
88	CH3OHH2O	methanol water dimer	InChI=1S/CH4O.H2O/c1-2;/h2H,1H3;1H2	GBMDVOWEEQVZKZ-UHFFFAOYSA-N	OC.O
88	CH3OHH2O	methanol water dimer	InChI=1S/CH6O2/c1-3-4-2/h2H2,1H3	RLIANZSMIKXDSS-UHFFFAOYSA-N
64175	CH3CH2OH	Ethanol	InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3	LFQSCWFLJHTTHZ-UHFFFAOYSA-N	CCO		Absolute ethanol; Alcohol; Ethanol; Ethyl alcohol; EtOH; Grain alcohol; Methylcarbinol
64175	CH3CH2OH	Ethanol	InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3	LFQSCWFLJHTTHZ-UHFFFAOYSA-N	CCO		Absolute ethanol; Alcohol; Ethanol; Ethyl alcohol; EtOH; Grain alcohol; Methylcarbinol
2154598	CF2-	Difluoromethylene anion	InChI=1S/CF2/c2-1-3/q-1	AMBFVCAELNSIML-UHFFFAOYSA-N	F[C-]F
2154598	CF2	Difluoromethylene	InChI=1S/CF2/c2-1-3	LTVOKYUPTHZZQH-UHFFFAOYSA-N	F[C]F		Difluoromethylene
2154598	CF2+	Difluoromethylene cation	InChI=1S/CF2/c2-1-3/q+1	GABNKAYPQUNMGY-UHFFFAOYSA-N	F[C+]F
3744078	NF2	Difluoroamino radical	InChI=1S/F2N/c1-3-2	BBZREMAMWBDNHH-UHFFFAOYSA-N	F[N]F		Difluoroamidogen; Difluoroamino radical
3744078	NF2+	Difluoroamino cation	InChI=1S/F2N/c1-3-2/q+1	MRTSUKPKYZWSDW-UHFFFAOYSA-N	F[N+]F
1871245	FCO	Carbonyl fluoride	InChI=1S/CFO/c2-1-3	CJXGPJZUDUOZDX-UHFFFAOYSA-N	F[C]=O
1871245	FCO+	Carbonyl fluoride cation	InChI=1S/CFO/c2-1-3/q+1	BCBJDTWSGXYIEB-UHFFFAOYSA-N	F[C+][O]
1495507	FCN	Cyanogen fluoride	InChI=1S/CFN/c2-1-3	CPPKAGUPTKIMNP-UHFFFAOYSA-N	FC#N
15499237	FOO	Dioxygen monofluoride radical	InChI=1S/FO2/c1-3-2	GQRAHKRZRKCZPQ-UHFFFAOYSA-N	FO[O]		Oxygen fluoride
15499237	FOO+	Fluorine dioxide cation	InChI=1S/FO2/c1-3-2/q+1		O=[O+]F		Dioxygen monofluoride cation
13842552	BF2	Boron difluoride radical	InChI=1S/BF2/c2-1-3	OKZIUSOJQLYFSE-UHFFFAOYSA-N	F[B]F
25730998	F3-	trifluoride anion	InChI=1S/F2.FH/c1-2;/h;1H/p-1	IGFHKBDKODMYIU-UHFFFAOYSA-M	FF.[F-]
25730998	F3-	trifluoride anion	InChI=1S/F3/c1-3-2/q-1	YOJONUWAMPIOKB-UHFFFAOYSA-N	FF.[F-]
25730998	F3-	trifluoride anion	InChI=1S/F2.FH/c1-2;/h;1H/p-1	IGFHKBDKODMYIU-UHFFFAOYSA-M	FF.[F-]
23361560	FBO	Boron monofluoride monoxide	InChI=1S/BFO/c2-1-3		FB=O		Boron fluoride oxide; Fluorooxoborane
7789255	FNO	Nitrosyl fluoride	InChI=1S/FNO/c1-2-3	ZEIYBPGWHWECHV-UHFFFAOYSA-N	O=NF		Nitrogen oxide fluoride; Nitrogen oxyfluoride; Nitrosyl fluoride
7787497	BeF2	Beryllium fluoride	InChI=1S/Be.2FH/h;2*1H/q+2;;/p-2	JZKFIPKXQBZXMW-UHFFFAOYSA-L	F[Be]F
7783417	F2O	Difluorine monoxide	InChI=1S/F2O/c1-3-2	UJMWVICAENGCRF-UHFFFAOYSA-N	FOF		Difluorine monooxide; Difluorine monoxide; Fluorine monoxide; Fluorine oxide; Oxydifluoride; Oxygen difluoride; Oxygen fluoride; Oxygen fluoride (OF2); hypofluorous anhydride
866495150	CNF	iso cyanogen fluoride	InChI=1S/CFN/c1-3-2		[C]#[N]F		Fluorine isocyanide
10405273	NHF2	difluoramine	InChI=1S/F2HN/c1-3-2/h3H	ULFHSQLFQYTZLS-UHFFFAOYSA-N	FNF
13709836	BHF2	Difluoroborane	InChI=1S/BF2H/c2-1-3/h1H	LRZMJFRZMNWFKE-UHFFFAOYSA-N	FBF		Difluoroborane
1493023	HFCO	formyl fluoride	InChI=1S/CHFO/c2-1-3/h1H	NHGVZTMBVDFPHJ-UHFFFAOYSA-N	O=CF
1493023	HFCO+	formyl fluoride cation	InChI=1S/CHFO/c2-1-3/h1H/q+1	PAJYIZZRXQZSJP-UHFFFAOYSA-N	[O][CH+]F
2713099	HCCF	Fluoroacetylene	InChI=1S/C2HF/c1-2-3/h1H	IAWCIZWLKMTPLL-UHFFFAOYSA-N	C#CF		Ethyne, fluoro-; Fluoroethyne; Monofluoroacetylene; Acetylene, fluoro-
2713099	HCCF+	fluoroacetylene cation	InChI=1S/C2HF/c1-2-3/h1H/q+1	GLCHAECFVXVCHF-UHFFFAOYSA-N	F[C]=[CH+]
2670135	CHF2	difluoromethyl radical	InChI=1S/CHF2/c2-1-3/h1H	JNCMHMUGTWEVOZ-UHFFFAOYSA-N	F[CH]F		Methyl radical, difluoro-
2670135	CHF2+	difluoromethyl cation	InChI=1S/CHF2/c2-1-3/h1H/q+1		F[CH+]F
75105	CH2F2	Methane, difluoro-	InChI=1S/CH2F2/c2-1-3/h1H2	RWRIWBAIICGTTQ-UHFFFAOYSA-N	FCF		Carbon fluoride hydride (CF2H2); Difluoromethane; Freon 32; Genetron 32; Methane, difluoro-; Methylene difluoride; Methylene fluoride; R 32
75025	CH2CHF	Ethene, fluoro-	InChI=1S/C2H3F/c1-2-3/h2H,1H2	XUCNUKMRBVNAPB-UHFFFAOYSA-N	FC=C		Ethene, fluoro-; Ethylene, fluoro-; Fluoroethene; Fluoroethylene; Monofluoroethylene; Vinyl fluoride, inhibited; Vinyl fluoride
75025	CH2CHF+	fluoroethene cation	InChI=1S/C2H3F/c1-2-3/h2H,1H2/q+1	GXYYCSRGMIQABH-UHFFFAOYSA-N	[CH2][CH+]F
420031	CH2FOH	fluoromethanol	InChI=1S/CH3FO/c1-3-2/h1H3	XMSZANIMCDLNKA-UHFFFAOYSA-N	FCO
353366	C2H5F	fluoroethane	InChI=1S/C2H5F/c1-2-3/h2H2,1H3	UHCBBWUQDAVSMS-UHFFFAOYSA-N	CCF		Ethyl fluoride; Ethane, fluoro-; Monofluoroethane; fluoroethane
143339	NaCN	Sodium Cyanide	InChI=1S/CN.Na/c1-2;	RTVFYQXEHKQMKO-UHFFFAOYSA-N	N#C[Na]
143339	NaCN	Sodium Cyanide	InChI=1S/CN.Na/c1-2;	RTVFYQXEHKQMKO-UHFFFAOYSA-N	N#C[Na]
143339	NaCN	Sodium Cyanide	InChI=1S/CN.Na/c1-2;	RTVFYQXEHKQMKO-UHFFFAOYSA-N	[C]#[N][Na]
1313593	Na2O	disodium monoxide	InChI=1S/2Na.O	QVUYWFOHKOTLOB-UHFFFAOYNA-N	[Na]O[Na]		Sodium oxide; Disodium oxide
1313593	Na2O	disodium monoxide	InChI=1S/2Na.O	QVUYWFOHKOTLOB-UHFFFAOYNA-N	[Na]O[Na]		Sodium oxide; Disodium oxide
12034127	NaO2	Sodium superoxide	InChI=1S/Na.O2/c;1-2/q+2;-2		[Na]1OO1
124414	NaOCH3	Sodium methoxide	InChI=1S/CH3O.Na/c1-2;/h1H3;/q-1;+1	WQDUMFSSJAZKTM-UHFFFAOYSA-N	[Na]OC		sodium methanolate
1309428	Mg(OH)2	Magnesium dihydroxide	InChI=1S/Mg.2H2O/h;2*1H2/q+2;;/p-2	VTHJTEIRLNZDEV-UHFFFAOYSA-L	O[Mg]O
1309428	Mg(OH)2	Magnesium dihydroxide	InChI=1S/Mg.2H2O/h;2*1H2/q+2;;/p-2	VTHJTEIRLNZDEV-UHFFFAOYSA-L	O[Mg]O
7783406	MgF2	Magnesium fluoride	InChI=1S/2FH.Mg/h2*1H;/q;;+2/p-2	ORUIBWPALBXDOA-UHFFFAOYSA-L	F[Mg]F
19401015	AlCN	Aluminum monocyanide	InChI=1S/CN.Al/c1-2;		[Al]C#N		Aluminum cyanide
61192709	AlNC	Aluminum isocyanide	InChI=1S/CN.Al/c1-2;		[Al][N]#[C]
12071271	SiC2	Silicon dicarbide	InChI=1S/C2Si/c1-2-3-1		[Si]1C#C1
7783268	Si3H8	trisilane	InChI=1S/H8Si3/c1-3-2/h3H2,1-2H3	VEDJZFSRVVQBIL-UHFFFAOYSA-N	[SiH3][SiH2][SiH3]		Silicopropane; Trisilicane
1111746	SiH2(CH3)2	dimethylsilane	InChI=1S/C2H8Si/c1-3-2/h3H2,1-2H3	UBHZUDXTHNMNLD-UHFFFAOYSA-N	C[SiH2]C
7631869	SiO2	silicon dioxide	InChI=1S/O2Si/c1-3-2	VYPSYNLAJGMNEJ-UHFFFAOYSA-N	O=[Si]=O		Amorphous silica gel; Silica; Silicic anhydride; Silicon dioxide; Silicon oxide; Silicon(IV) oxide
1396660	SiF2	Silicon difluoride	InChI=1S/F2Si/c1-3-2	MGNHOGAVECORPT-UHFFFAOYSA-N	F[Si]F		Difluorosilylene; Silicon difluoride
1396660	SiF2+	Silicon difluoride cation	InChI=1S/F2Si/c1-3-2/q+1	WPLNUGDSAZHARN-UHFFFAOYSA-N	F[Si+]F
13824367	SiH2F2	difluorosilane	InChI=1S/F2H2Si/c1-3-2/h3H2	PUUOOWSPWTVMDS-UHFFFAOYSA-N	F[SiH2]F		Silane, difluoro-
753446	CH3SiFH2	fluoromethylsilane	InChI=1S/CH5FSi/c1-3-2/h3H2,1H3		C[SiH2]F
676595	CH3PHCH3	dimethylphosphine	InChI=1S/C2H7P/c1-3-2/h3H,1-2H3	YOTZYFSGUCFUKA-UHFFFAOYSA-N	CPC
114584268	PPO	Phosphorus oxide phosphide	InChI=1S/OP2/c1-3-2	BUYIAIMTTAEIOB-UHFFFAOYSA-N	[P-][P+]=O
12164975	PO2-	Phosphorus dioxide anion	InChI=1S/HO2P/c1-3-2/h(H,1,2)/p-1	GQZXNSPRSGFJLY-UHFFFAOYSA-M	[O-]P=O
12164975	PO2	Phosphorus dioxide	InChI=1S/O2P/c1-3-2	CJDZTJNITSFKRE-UHFFFAOYSA-N	O=[P]=O
12164975	PO2+	Phosphorus dioxide cation	InChI=1S/O2P/c1-3-2/q+1	JXHYXDDQABAXTQ-UHFFFAOYSA-N	O=[P+]=O
13873524	PF2	Phosphorus difluoride	InChI=1S/F2P/c1-3-2	MSGYRGHIEBLFLX-UHFFFAOYSA-N	F[P]F
13873524	PF2+	Phosphorus difluoride cation	InChI=1S/F2P/c1-3-2/q+1		F[P+]F
13759109	SiS2	Silicon disulfide	InChI=1S/S2Si/c1-3-2	KHDSWONFYIAAPE-UHFFFAOYSA-N	[S][Si][S]		silicon disulphide
15941772	SCN-	thiocyanide anion	InChI=1S/CNS/c2-1-3/q-1	ZBKFYXZXZJPWNQ-UHFFFAOYSA-N	S=C=[N-]		thiocyanate
15941772	SCN	thiocyanato radical	InChI=1S/CNS/c2-1-3	NYAZXHASVIWIRJ-UHFFFAOYSA-N	[N]=C=S
56400023	NNS	Nitrogen sulfide	InChI=1S/N2S/c1-2-3	OBISXEJSEGNNKL-UHFFFAOYSA-N	[N-]=[N+]=S		Dinitrogen-N-sulfide; Nitrous sulfide
56971198	SNO	Nitrogen oxide sulfide	InChI=1S/NOS/c2-1-3		[S]N=O
20901217	SSO	Disulfur monoxide	InChI=1S/OS2/c1-3-2	TXKMVPPZCYKFAC-UHFFFAOYSA-N	S=S=O		Sulfur oxide; sulfur oxide sulfide
12136582	Li2S	dilithium sulfide	InChI=1S/2Li.S	ZWDBUTFCWLVLCQ-UHFFFAOYSA-N	[Li]S[Li]
12136582	Li2S	dilithium sulfide	InChI=1S/2Li.S	ZWDBUTFCWLVLCQ-UHFFFAOYSA-N	[Li]S[Li]
12597034	S3-	Sulfur trimer anion	InChI=1S/HS3/c1-3-2/h1H/p-1	WMXWXNVGXOWZRJ-UHFFFAOYSA-M	[S]S[S-]
12597034	S3	Sulfur trimer	InChI=1S/S3/c1-3-2	NVSDADJBGGUCLP-UHFFFAOYSA-N	S=S=S
12597034	S3	Sulfur trimer	InChI=1S/S3/c1-2-3-1		S1SS1
12597034	S3+	Sulfur trimer cation	InChI=1S/S3/c1-3-2/q+1	YKEMVFDZPHZNKQ-UHFFFAOYSA-N	[S][S+][S]
7446095	SO2-	Sulfur dioxide anion	InChI=1S/HO2S/c1-3-2/h(H,1,2)/p-1	HYBXAXQJRPECRK-UHFFFAOYSA-M	[O-][S]=O
7446095	SO2-	Sulfur dioxide anion	InChI=1S/O2S/c1-3-2/q-1	SAKOVUXOZRPMTC-UHFFFAOYSA-N	[O][S-][O]
7446095	SO2	Sulfur dioxide	InChI=1S/O2S/c1-3-2	RAHZWNYVWXNFOC-UHFFFAOYSA-N	O=S=O		Bisulfite; Fermenicide liquid; Fermenicide powder; Fermenticide liquid; Schwefeldioxyd; Siarki dwutlenek; Sulfur dioxide; Sulfur oxide; Sulfur oxide (SO2); Sulfurous acid anhydride; Sulfurous anhydride; Sulfurous oxide; Sulphur dioxide
7446095	SO2+	Sulfur dioxide cation	InChI=1S/O2S/c1-3-2/q+1	MBSJVKCGZVUJLB-UHFFFAOYSA-N	[O][S+][O]
1313822	Na2S	Sodium sulfide	InChI=1S/2Na.S		[Na]S[Na]		disodium sulfide
1313822	Na2S	Sodium sulfide	InChI=1S/2Na.S		[Na]S[Na]		disodium sulfide
463581	OCS	Carbonyl sulfide	InChI=1S/COS/c2-1-3	JJWKPURADFRFRB-UHFFFAOYSA-N	O=C=S		Carbon oxide sulfide; Carbon oxide sulfide (COS); Carbon oxysulfide; Carbonyl sulfide; Oxycarbon sulfide
463581	OCS+	Carbonyl sulfide cation	InChI=1S/COS/c2-1-3/q+1	BTRSGXSEZDOXRY-UHFFFAOYSA-N	S=[C+]=O
75150	CS2-	Carbon disulfide anion	InChI=1S/CS2/c2-1-3/q-1	IKZNEQNDDPLVNV-UHFFFAOYSA-N	[S-][C]=S
75150	CS2	Carbon disulfide	InChI=1S/CS2/c2-1-3	QGJOPFRUJISHPQ-UHFFFAOYSA-N	S=C=S		Carbon bisulfide; Carbon bisulphide; Carbon disulfide; Carbon sulfide; Carbon sulfide (CS2); Carbon sulphide; Carbon-disulphide-; Carbone; Carbonio; Dithiocarbonic anhydride; Kohlendisulfid; Koolstofdisulfide; Schwefelkohlenstoff; Solfuro di carbonio; Sulphocarbonic anhydride; Weeviltox; Wegla dwusiarczek
75150	CS2+	Carbon disulfide cation	InChI=1S/CS2/c2-1-3/q+1	PGXKVSYXGLLKDQ-UHFFFAOYSA-N	S=C=[S+]
166412619	NSO	sulfinyl amidogen	InChI=1S/NOS/c1-3-2		O=S=[N]
463569	HSCN	thiocyanic acid	InChI=1S/CHNS/c2-1-3/h3H	ZMZDMBWJUHKJPS-UHFFFAOYSA-N	SC#N		Hydrogen thiocyanate; Sulfocyanic acid
3129906	HNCS	Isothiocyanic acid	InChI=1S/CHNS/c2-1-3/h2H	GRHBQAYDJPGGLF-UHFFFAOYSA-N	S=C=N		Hydrogen isothiocyanate
12306079	SO2H+	protonated sulfur dioxide	InChI=1S/HO2S/c1-3-2/h(H,1,2)	RAHZWNYVWXNFOC-UHFFFAOYSA-O	[O][S+]=O
87552861	CS2H+	Carbon disulfide, protonated	InChI=1S/CS2/c2-1-3/p+1		S=C=[SH+]
18282774	CH2CS	Thioketene	InChI=1S/C2H2S/c1-2-3/h1H2	CWMKZYCJCZVSHO-UHFFFAOYSA-N	C=C=S		Ethenethione; Ketene, thio-
13845233	HSSSH	trisulfane	InChI=1S/H2S3/c1-3-2/h1-2H	KBMBVTRWEAAZEY-UHFFFAOYSA-N	SSS
13845233	HSSSH	trisulfane	InChI=1S/H2S3/c1-3-2/h1-2H	KBMBVTRWEAAZEY-UHFFFAOYSA-N	SSS
60100109	NHCHSH	Methanimidothioic acid	InChI=1S/CH3NS/c2-1-3/h1H,(H2,2,3)
115082	CHSNH2	thioformamide	InChI=1S/CH3NS/c2-1-3/h1H,(H2,2,3)	CYEBJEDOHLIWNP-UHFFFAOYSA-N	S=CN		Methanethioamide
420122	C2H4S	Thiirane	InChI=1S/C2H4S/c1-2-3-1/h1-2H2	VOVUARRWDCVURC-UHFFFAOYSA-N	S1CC1		2,3-Dihydrothiirene; Ethylene episulfide; Ethylene episulphide; Ethylene sulfide; Ethylene sulphide; Sulfurane; Thiacyclopropane; Thiirane; Thiirene, 2,3-dihydro-
6851930	CH3CHS	Thioacetaldehyde	InChI=1S/C2H4S/c1-2-3/h2H,1H3	QJFUMFCCMJJLIE-UHFFFAOYSA-N	CC=S		Thioacetaldehyde; ethanethial
6725640	HSCH2SH	Methanedithiol	InChI=1S/CH4S2/c2-1-3/h2-3H,1H2	INBDPOJZYZJUDA-UHFFFAOYSA-N	SCS		dithiomethane; Dimercaptomethane
6251269	CH3SSH	Hydrogen methyl disulfide	InChI=1S/CH4S2/c1-3-2/h2H,1H3	KFLNNVFDKSNGBW-UHFFFAOYSA-N	CSS		Methanesulfenothioic acid; Methyl hydrodisulfide; Methanesulfenic acid, thio-
917599	CH2CHSH	Ethenethiol	InChI=1S/C2H4S/c1-2-3/h2-3H,1H2	QDXBVEACAWKSFL-UHFFFAOYSA-N	C=CS		Ethylenethiol; Mercaptoethylene; Vinyl mercaptan; Vinylthiol
75183	CH3SCH3	Dimethyl sulfide	InChI=1S/C2H6S/c1-3-2/h1-2H3	QMMFVYPAHWMCMS-UHFFFAOYSA-N	CSC		2-Thiapropane; 2-Thiopropane; Dimethyl monosulfide; Dimethyl sulfide; Dimethyl sulphide; Dimethyl thioether; Dimethylsulfid; DMS; Exact-S; Methane, thiobis-; Methyl Monosulfide; Methyl sulfide; Methyl sulphide; Methylthiomethane; Sulfure de methyle; Thiobismethane; dimethylsulfane
75183	CH3SCH3+	dimethyl sulfide cation	InChI=1S/C2H6S/c1-3-2/h1-2H3/q+1		C[S+]C
75081	CH3CH2SH	ethanethiol	InChI=1S/C2H6S/c1-2-3/h3H,2H2,1H3	DNJIEGIFACGWOD-UHFFFAOYSA-N	CCS		1-Mercaptoethane; Aethanethiol; Aethylmercaptan; Etantiolo; Ethaanthiol; Ethanethiol; Ethyl hydrosulfide; Ethyl mercaptan; Ethyl sulfhydrate; Ethyl thioalcohol; Ethylmercaptaan; Ethylmerkaptan; Etilmercaptano; LPG ethyl mercaptan 1010; Mercaptoethane; Thioethanol; Thioethyl alcohol
75081	CH3CH2SH	ethanethiol	InChI=1S/C2H6S/c1-2-3/h3H,2H2,1H3	DNJIEGIFACGWOD-UHFFFAOYSA-N	CCS		1-Mercaptoethane; Aethanethiol; Aethylmercaptan; Etantiolo; Ethaanthiol; Ethanethiol; Ethyl hydrosulfide; Ethyl mercaptan; Ethyl sulfhydrate; Ethyl thioalcohol; Ethylmercaptaan; Ethylmerkaptan; Etilmercaptano; LPG ethyl mercaptan 1010; Mercaptoethane; Thioethanol; Thioethyl alcohol
18820638	FSN	Thiazyl fluoride	InChI=1S/FNS/c1-3-2	IMFUYZDKLVTPSW-UHFFFAOYSA-N	N#SF
13814250	SF2-	sulfur difluoride anion	InChI=1S/F2S/c1-3-2/q-1	OFRKWDJNZFLIKU-UHFFFAOYSA-N	F[S-]F
13814250	SF2-	sulfur difluoride anion	InChI=1S/F2S/c1-3-2/q-1	OFRKWDJNZFLIKU-UHFFFAOYSA-N	F[S-]F
13814250	SF2	sulfur difluoride	InChI=1S/F2S/c1-3-2	QTJXVIKNLHZIKL-UHFFFAOYSA-N	FSF
13814250	SF2+	sulfur difluoride cation	InChI=1S/F2S/c1-3-2/q+1	MZABPRZNSYSBEJ-UHFFFAOYSA-N	F[S+]F
13537387	FNS	Thionitrosyl fluoride	InChI=1S/FNS/c1-2-3	VOGIKJZKYJITFG-UHFFFAOYSA-N	S=NF
10545990	SCl2	Sulfur dichloride	InChI=1S/Cl2S/c1-3-2	FWMUJAIKEJWSSY-UHFFFAOYSA-N	ClSCl		Sulfur chloride; Chlorine sulfide; Dichlorosulfane; Monosulfur dichloride; Sulfur(II) chloride; Chloride of sulfur; hypochlorous thioanhydride
10049044	OClO-	Chlorine dioxide anion	InChI=1S/ClO2/c2-1-3/q-1	GXXLZZYHIIGRLP-UHFFFAOYSA-N	[O-]Cl[O]
10049044	OClO-	Chlorine dioxide anion	InChI=1S/ClHO2/c2-1-3/h(H,2,3)/p-1	QBWCMBCROVPCKQ-UHFFFAOYSA-M	[O-][Cl]=O
10049044	OClO	Chlorine dioxide	InChI=1S/ClO2/c2-1-3	OSVXSBDYLRYLIG-UHFFFAOYSA-N	O=Cl[O]		Alcide; Anthium dioxcide; Chlorine dioxide; Chlorine oxide; Chlorine oxide (ClO2); Chlorine peroxide; Chlorine(IV) oxide; Chloroperoxyl; Chloryl radical; Doxcide 50
10049044	OClO+	Chlorine dioxide cation	InChI=1S/ClO2/c2-1-3/q+1	UVQYMEMTCMFUIN-UHFFFAOYSA-N	[O][Cl+][O]
7787475	BeCl2	Beryllium chloride	InChI=1S/Be.2ClH/h;2*1H/q+2;;/p-2	LWBPNIJBHRISSS-UHFFFAOYSA-L	Cl[Be]Cl
7786303	MgCl2	Magnesium dichloride	InChI=1S/2ClH.Mg/h2*1H;/q;;+2/p-2	TWRXJAOTZQYOKJ-UHFFFAOYSA-L	Cl[Mg]Cl		Magnesium chloride
7791211	Cl2O	Dichlorine monoxide	InChI=1S/Cl2O/c1-3-2	RCJVRSBWZCNNQT-UHFFFAOYSA-N	ClOCl		Chlorine monooxide; Chlorine monoxide; Chlorine monoxide (Cl2O); Chlorine oxide; Chlorine oxide (Cl2O); Chlorine(I) oxide; Dichlorine monoxide; Dichloromonoxide; Dichloroxide; Hypochlorous anhydride
13569329	SiCl2	Dichlorosilylene	InChI=1S/Cl2Si/c1-3-2	BUMGIEFFCMBQDG-UHFFFAOYSA-N	Cl[Si]Cl		Dichlorosilylene; silicon dichloride
17376099	ClOO	chloroperoxy radical	InChI=1S/ClO2/c1-3-2	ASCHNMXUWBEZDM-UHFFFAOYSA-N	ClO[O]
17376099	ClOO+	chloroperoxy cation	InChI=1S/ClO2/c1-3-2/q+1	JILSWHWPVMTOIP-UHFFFAOYSA-N	Cl[O+]=O
18434338	Cl3-	trichloride anion	InChI=1S/Cl3/c1-3-2/q-1	MYTVFXOCDZDTLX-UHFFFAOYSA-N	Cl[Cl-]Cl
22363684	FClO	chlorosyl fluoride	InChI=1S/ClFO/c2-1-3	AXCBHWGTRNNXKG-UHFFFAOYSA-N	FCl=O
21295501	OPCl	Phosphorus oxychloride	InChI=1S/ClOP/c1-3-2		O=PCl		Phosphorus chloride oxide
64422260	SFCl	Sulfur chloride fluoride	InChI=1S/ClFS/c1-3-2		FSCl
53169269	ClSO	Sulfur chloride oxide	InChI=1S/ClOS/c1-3-2	JBZRLVKMCLOFLG-UHFFFAOYSA-N	Cl[S]=O		Chlorothionyl
39594917	ClS2	Sulfur chloride	InChI=1S/ClS2/c1-3-2	ASGYIKBYZKQKJC-UHFFFAOYSA-N	ClS[S]		Sulfur chloride
34240863	ClOF	Chlorine hypofluorite	InChI=1S/ClFO/c1-3-2	OBSJTVYTJSDZEO-UHFFFAOYSA-N	ClOF
506774	ClCN	chlorocyanogen	InChI=1S/CClN/c2-1-3	QPJDMGCKMHUXFD-UHFFFAOYSA-N	N#CCl		Chlorcyan; Chlorine cyanide; Chlorocyan; Chlorocyanide; Chlorocyanogen; Chlorure de cyanogene; CK; Cyanochloride; Cyanogen chloride; Cyanogen chloride ((CN)Cl); Cyanogen chloride, inhibited; cyanic chloride
1691889	CFCl	chlorofluoromethylene	InChI=1S/CClF/c2-1-3	KYKAJFCTULSVSH-UHFFFAOYSA-N	F[C]Cl		Chlorofluorocarbene; fluorochloromethylene
1605727	CCl2-	dichloromethylene anion	InChI=1S/CCl2/c2-1-3/q-1	OZJHVHSKMWSCKB-UHFFFAOYSA-N	Cl[C]Cl
1605727	CCl2	dichloromethylene	InChI=1S/CCl2/c2-1-3	PFBUKDPBVNJDEW-UHFFFAOYSA-N	Cl[C]Cl
1605727	CCl2+	dichloromethylene cation	InChI=1S/CCl2/c2-1-3/q+1	BMNPTARFHVPKCA-UHFFFAOYSA-N	Cl[C+]Cl
2696926	ClNO	Nitrosyl chloride	InChI=1S/ClNO/c1-2-3	VPCDQGACGWYTMC-UHFFFAOYSA-N	O=NCl		Nitrogen chloride oxide (NOCl); Nitrogen oxide chloride (NOCl); Nitrogen oxychloride; Nitrogen oxychloride (NOCl); Nitrosyl chloride; Nitrosyl chloride ((NO)Cl)
2602428	ClCO	carbonyl monochloride	InChI=1S/CClO/c2-1-3	DDKMFOUTRRODRE-UHFFFAOYSA-N	O=[C]Cl
2602428	ClCO	carbonyl monochloride	InChI=1S/CClO/c2-1-3	DDKMFOUTRRODRE-UHFFFAOYSA-N	O=[C]Cl
3400097	NHCl2	dichloroamine	1S/Cl2HN/c1-3-2/h3H	JSYGRUBHOCKMGQ-UHFFFAOYSA-N	ClNCl
3474122	CHCl2	dichloromethyl radical	InChI=1S/CHCl2/c2-1-3/h1H	ZJULYDCRWUEPTK-UHFFFAOYSA-N	Cl[CH]Cl		Methyl, dichloro-; Dichloromethyl
3474122	CHCl2	dichloromethyl radical	InChI=1S/CHCl2/c2-1-3/h1H	ZJULYDCRWUEPTK-UHFFFAOYSA-N	Cl[CH]Cl		Methyl, dichloro-; Dichloromethyl
3474122	CHCl2+	dichloromethyl cation	InChI=1S/CHCl2/c2-1-3/h1H/q+1		Cl[CH+]Cl
2565302	COHCl	Formyl chloride	InChI=1S/CHClO/c2-1-3/h1H	GFAUNYMRSKVDJL-UHFFFAOYSA-N	O=CCl
593635	HCCCl	Chloroacetylene	InChI=1S/C2HCl/c1-2-3/h1H	DIWKDXFZXXCDLF-UHFFFAOYSA-N	C#CCl		Ethyne, chloro-; Acetylene, chloro-; Chloroethyne; Ethynyl chloride; Monochloroacetylene
33272718	CHFCl	Chlorofluoromethyl radical	InChI=1S/CHClF/c2-1-3/h1H	FICFQLDYKDCJHQ-UHFFFAOYSA-N	F[CH]Cl
33272718	CHFCl+	Chlorofluoromethyl cation	InChI=1S/CHClF/c2-1-3/h1H/q+1		F[CH+]Cl
13898470	HOClO	Chlorous acid	InChI=1S/ClHO2/c2-1-3/h2H	NPWPEPVYKMPDKK-UHFFFAOYSA-N	OCl[O]		Chlorous acid
13898470	HOClO	Chlorous acid	InChI=1S/ClHO2/c2-1-3/h2H	NPWPEPVYKMPDKK-UHFFFAOYSA-N	OCl[O]		Chlorous acid
10325390	BHCl2	Borane, dichloro-	InChI=1S/BCl2H/c2-1-3/h1H	LHCGBIFHSCCRRG-UHFFFAOYSA-N	ClBCl		Borane, dichloro-; Dichloroborane
593704	CH2FCl	fluorochloromethane	InChI=1S/CH2ClF/c2-1-3/h1H2	XWCDCDSDNJVCLO-UHFFFAOYSA-N	ClCF		Methane, chlorofluoro-; Chlorofluoromethane; Freon 31; Monochloromonofluoromethane; R 31
4109960	SiH2Cl2	dichlorosilane	InChI=1S/Cl2H2Si/c1-3-2/h3H2	MROCJMGDEKINLD-UHFFFAOYSA-N	Cl[SiH2]Cl
75092	CH2Cl2	Methylene chloride	InChI=1S/CH2Cl2/c2-1-3/h1H2	YMWUJEATGCHHMB-UHFFFAOYSA-N	ClCCl		Aerothene MM; Chlorure de methylene; DCM; Dichloromethane; Freon 30; Methane dichloride; Methane, dichloro-; Methylene bichloride; Methylene Chloride; Methylene dichloride; Metylenu chlorek; Narkotil; R 30; Solaesthin; Solmethine
75014	C2H3Cl	Ethene, chloro-	InChI=1S/C2H3Cl/c1-2-3/h2H,1H2	BZHJMEDXRYGGRV-UHFFFAOYSA-N	ClC=C		Chlorethene; Chlorethylene; Chloroethene; Chloroethylene; Chlorure de vinyle; Cloruro di vinile; Ethene, chloro-; Ethylene monochloride; Ethylene, chloro-; Monochloroethene; Monochloroethylene; Vinyl chloride monomer; Vinylchlorid; Winylu chlorek; VC; Vinyl C monomer; Vinyl chloride; Vinyl chloride, inhibited; Trovidur; Vinyle(chlorure de); VCM; Vinile
593782	CH3OCl	methyl hypochlorite	InChI=1S/CH3ClO/c1-3-2/h1H3	UCFFGYASXIPWPD-UHFFFAOYSA-N	COCl
16519996	CH2CH2Cl	2-chloroethyl radical	InChI=1S/C2H4Cl/c1-2-3/h1-2H2	WOWSRBBIBJLBJW-UHFFFAOYSA-N	[CH2]CCl		β-Chloroethyl; β-Chloroethyl radical
16520131	CHClCH3	1-chloroethyl radical	InChI=1S/C2H4Cl/c1-2-3/h2H,1H3	JSICDMRDIHNAKT-UHFFFAOYSA-N	C[CH]Cl		Ethyl, 1-​chloro-; α-Chloroethyl
75003	CH3CH2Cl	Ethyl chloride	InChI=1S/C2H5Cl/c1-2-3/h2H2,1H3	HRYZWHHZPQKTII-UHFFFAOYSA-N	CCCl		Chloroethane; Ethane, chloro-; Ethyl Chloride; Monochloroethane
151508	KCN	Potassium cyanide	InChI=1S/CN.K/c1-2;	YUZRZFQHUCKACF-UHFFFAOYSA-N	N#C[K]
151508	KCN	Potassium cyanide	InChI=1S/CN.K/c1-2;	YUZRZFQHUCKACF-UHFFFAOYSA-N	[C]#[N][K]
151508	KCN	Potassium cyanide	InChI=1S/CN.K/c1-2;	YUZRZFQHUCKACF-UHFFFAOYSA-N	[C]1[N-][K+]1
10043524	CaCl2	Calcium Chloride	InChI=1S/Ca.2ClH/h;2*1H/q+2;;/p-2	UXVMQQNJUSDDNG-UHFFFAOYSA-L	Cl[Ca]Cl
7789755	CaF2	Calcium difluoride	InChI=1S/Ca.2FH/h;2*1H/q+2;;/p-2	WUKWITHWXAAZEY-UHFFFAOYSA-L	F[Ca]F		Fluorite; Calcium fluoride; Acid-spar; Fluorspar
13463677	TiO2	Titanium dioxide	InChI=1S/2O.Ti	GWEVSGVZZGPLCZ-UHFFFAOYSA-N	O=[Ti]=O
544923	CuCN	Copper cyanide	InChI=1S/CN.Cu/c1-2;	DULSAGLWMRMKCQ-UHFFFAOYSA-N	[Cu]C#N		cyanocopper
7789197	CuF2	Copper difluoride	InChI=1S/Cu.2FH/h;2*1H/q+2;;/p-2	GWFAVIIMQDUCRA-UHFFFAOYSA-L	F[Cu]F
544978	Zn(CH3)2	dimethyl zinc	InChI=1S/2CH3.Zn/h2*1H3;	AXAZMDOAUQTMOW-UHFFFAOYSA-N	C[Zn]C
544978	Zn(CH3)2	dimethyl zinc	InChI=1S/2CH3.Zn/h2*1H3;	AXAZMDOAUQTMOW-UHFFFAOYSA-N	C[Zn]C
544978	Zn(CH3)2	dimethyl zinc	InChI=1S/2CH3.Zn/h2*1H3;	AXAZMDOAUQTMOW-UHFFFAOYSA-N	C[Zn]C
73963981	ZnCN	Zinc monocyanide	InChI=1S/CN.Zn/c1-2;		[Zn]C#N		Zinc cyanide
748101419	ZnNC	Zinc isocyanide	InChI=1S/CN.Zn/c1-2;		[Zn][N]#[C]
7646857	ZnCl2	Zinc dichloride	InChI=1S/2ClH.Zn/h2*1H;/q;;+2/p-2	JIAARYAFYJHUJI-UHFFFAOYSA-L	Cl[Zn]Cl		Zinc chloride; zinc(II) chloride
7646857	ZnCl2	Zinc dichloride	InChI=1S/2ClH.Zn/h2*1H;/q;;+2/p-2	JIAARYAFYJHUJI-UHFFFAOYSA-L	Cl[Zn]Cl		Zinc chloride; zinc(II) chloride
7783495	ZnF2	Zinc difluoride	InChI=1S/2FH.Zn/h2*1H;/q;;+2/p-2	BHHYHSUAOQUXJK-UHFFFAOYSA-L	F[Zn]F
7783495	ZnF2	Zinc difluoride	InChI=1S/2FH.Zn/h2*1H;/q;;+2/p-2	BHHYHSUAOQUXJK-UHFFFAOYSA-L	F[Zn]F
12025342	GeS2	Germanium disulfide	InChI=1S/GeS2/c2-1-3	YIZVROFXIVWAAZ-UHFFFAOYSA-N	S=[Ge]=S		germanium disulphide
1310538	GeO2	Germanium dioxide	InChI=1S/GeO2/c2-1-3	YBMRDBCBODYGJE-UHFFFAOYSA-N	[O][Ge][O]
10060114	GeCl2	Germanium dichloride	InChI=1S/Cl2Ge/c1-3-2	QHGIKMVOLGCZIP-UHFFFAOYSA-N	Cl[Ge]Cl
13940631	GeF2	Germanium difluoride	InChI=1S/F2Ge/c1-3-2	GGJOARIBACGTDV-UHFFFAOYSA-N	F[Ge]F
12255128	AsO2	Aresenic dioxide	InChI=1S/AsO2/c2-1-3	LZYIDMKXGSDQMT-UHFFFAOYSA-N	[O][As][O]
1603845	OCSe	Carbonyl selenide	InChI=1S/COSe/c2-1-3	RQZJHKMUYSXABM-UHFFFAOYSA-N	O=C=[Se]
506809	CSe2	Carbon diselenide	InChI=1S/CSe2/c2-1-3	JNZSJDBNBJWXMZ-UHFFFAOYSA-N	[Se]=C=[Se]		Carbon selenide
5951199	SCSe	Carbon sulfide selenide	InChI=1S/CSSe/c2-1-3	UGVGOQWEDNFDPF-UHFFFAOYSA-N	S=C=[Se]		Carbo selenide; Thiocarbonyl selenide
7446084	SeO2	Selenium dioxide	InChI=1S/O2Se/c1-3-2	JPJALAQPGMAKDF-UHFFFAOYSA-N	O=[Se]=O		Selenium(IV) oxide; Selenium oxide; selenium dioxide
7446084	SeO2+	Selenium dioxide cation	InChI=1S/O2Se/c1-3-2/q+1	IZTZZSLQCBITTL-UHFFFAOYSA-N	O=[Se+]=O		Selenium oxide cation
593793	CH3SeCH3	dimethylselenide	InChI=1S/C2H6Se/c1-3-2/h1-2H3	RVIXKDRPFPUUOO-UHFFFAOYSA-N	C[Se]C		Selenium dimethyl; Dimethylselenium; Selenide, dimethyl-; Methyl selenide; Methyl selenium
14457706	SeCl2	Selenium Dichloride	InChI=1S/Cl2Se/c1-3-2	SWAKCLHCWHYEOW-UHFFFAOYSA-N	Cl[Se]Cl		Dichloroselenium
70421431	SeF2	Selenium difluoride	InChI=1S/F2Se/c1-3-2	YFFGQPRBGMOOJR-UHFFFAOYSA-N	FSeF
67177473	BrOO	Bromine dioxide	InChI=1S/BrO2/c1-3-2		BrO[O]
21308805	BrOBr	Bromine oxide	InChI=1S/Br2O/c1-3-2	HJCMMOODWZOXML-UHFFFAOYSA-N	BrOBr
22987457	SeBr2	Selenium dibromide	InChI=1S/Br2Se/c1-3-2	MNBLRJWKVLRTKV-UHFFFAOYSA-N	Br[Se]Br
21255834	OBrO	Bromine dioxide radical	InChI=1S/BrO2/c2-1-3	SISAYUDTHCIGLM-UHFFFAOYSA-N	[O]Br[O]
14312200	SBr2	Sulfur dibromide	InChI=1S/Br2S/c1-3-2	XXWVVIRTHDRMEY-UHFFFAOYSA-N	BrSBr
14522806	Br3-	tribromide anion	InChI=1S/Br3/c1-3-2/q-1		[Br-][Br+][Br-]
13444876	BrNO	Nitrosyl bromide	InChI=1S/BrNO/c1-2-3	BMNDJWSIKZECMH-UHFFFAOYSA-N	BrN=O
7789415	CaBr2	Calcium dibromide	InChI=1S/2BrH.Ca/h2*1H;/q;;+2/p-2		Br[Ca]Br		Calcium Bromide
7787464	BeBr2	Beryllium bromide	InChI=1S/Be.2BrH/h;2*1H/q+2;;/p-2	PBKYCFJFZMEFRS-UHFFFAOYSA-L	Br[Be]Br		Beryllium dibromide
9000328	BrOCl	Bromine hypochlorite	InChI=1S/BrClO/c1-3-2	QZMLUZQWJCKBQO-UHFFFAOYSA-N	BrOCl
4371771	CBr2	dibromomethylene	InChI=1S/CBr2/c2-1-3	WNLFIUJNNYMFIZ-UHFFFAOYSA-N	Br[C]Br		Carbon dibromide; Dibromocarbene; Methylene, dibromo-
506683	BrCN	Cyanogen bromide	InChI=1S/CBrN/c2-1-3	ATDGTVJJHBUTRL-UHFFFAOYSA-N	N#CBr		Bromine cyanide; Bromocyan; Bromocyanide; Bromocyanogen; Cyanobromide; Cyanogen monobromide; Bromine monocyanide; Cyanic bromide
593613	HCCBr	bromoacetylene	InChI=1S/C2HBr/c1-2-3/h1H	RUEKPBLTWGFBOD-UHFFFAOYSA-N	C#CBr		Acetylene, bromo-
7726116	COHBr	Formyl bromide	InChI=1S/CHBrO/c2-1-3/h1H	AIFARXRIYKCEEV-UHFFFAOYSA-N	O=CBr
14362131	CHBr2	dibromomethyl radical	InChI=1S/CHBr2/c2-1-3/h1H	HFPGRVHMFSJMOL-UHFFFAOYSA-N	Br[CH]Br		methyl, dibromo-
373524	CH2BrF	Methane, bromofluoro-	InChI=1S/CH2BrF/c2-1-3/h1H2	LHMHCLYDBQOYTO-UHFFFAOYSA-N	FCBr		Bromofluoromethane; Fluorobromomethane
74975	CH2BrCl	Methane, bromochloro-	InChI=1S/CH2BrCl/c2-1-3/h1H2	JPOXNPPZZKNXOV-UHFFFAOYSA-N	ClCBr		Bromochloromethane; Chlorobromomethane; Monochloromonobromomethane; Methylene chlorobromide
74953	CH2Br2	dibromomethane	InChI=1S/CH2Br2/c2-1-3/h1H2	FJBFPHVGVWTDIP-UHFFFAOYSA-N	BrCBr		Methylene dibromide; Dibromomethane; Methane, dibromo-; Methylene bromide
75161	CH3MgBr	Methyl Magnesium Bromide	InChI=1S/CH3.BrH.Mg/h1H3;1H;/q;;+1/p-1		C[Mg]Br		Magnesium, bromomethyl-; Bromomethylmagnesium; Methylmagnesium bromide
593602	C2H3Br	vinyl bromide	InChI=1S/C2H3Br/c1-2-3/h2H,1H2	INLLPKCGLOXCIV-UHFFFAOYSA-N	C=CBr		Ethene, bromo-; Vinylbromid; Bromoethene; Ethylene, bromo-; Bromoethylene; Bromure de vinyle
74964	C2H5Br	Ethyl bromide	InChI=1S/C2H5Br/c1-2-3/h2H2,1H3	RDHPKYGYEGBMSE-UHFFFAOYSA-N	CCBr		Halon 2001; Hydrobromic ether; Bromure d'ethyle; Monobromoethane; Bromoethane; Ethane, bromo-; Bromic ether; 1-Bromoethane
13773814	KrF2	Krypton difluoride	InChI=1S/F2Kr/c1-3-2	QGOSZQZQVQAYFS-UHFFFAOYSA-N	F[Kr]F
10340064	SCTe	Carbon sulfide Telluride	InChI=1S/CSTe/c2-1-3		S=C=[Te]		Thiocarbonyl telluride
7446073	TeO2	Tellurium Dioxide	InChI=1S/O2Te/c1-3-2	LAJZODKXOMJMPK-UHFFFAOYSA-N	O=[Te]=O
506785	ICN	Cyanogen iodide	InChI=1S/CIN/c2-1-3	WPBXOELOQKLBDF-UHFFFAOYSA-N	IC#N		Iodine cyanide; Cyanogen monoiodide; Iodine monocyanide; Carbononitridic iodide
14900040	I3-	triiodide	InChI=1S/I3/c1-3-2/q-1		I[I-]I		iodide; Iodine triatomic anion
58585947	INO	Nitrosyl iodide	InChI=1S/INO/c1-2-3	VBAXOVGEFYCYMW-UHFFFAOYSA-N	O=NI
373535	CH2FI	fluoroiodomethane	InChI=1S/CH2FI/c2-1-3/h1H2	XGVXNTVBGYLJIR-UHFFFAOYSA-N	FCI
75116	CH2I2	Diiodomethane	InChI=1S/CH2I2/c2-1-3/h1H2	NZZFYRREKKOMAT-UHFFFAOYSA-N	ICI		methylene iodide; Methylene diiodide
593715	CH2ClI	chloroiodomethane	InChI=1S/CH2ClI/c2-1-3/h1H2	PJGJQVRXEUVAFT-UHFFFAOYSA-N	ClCI
557686	CH2BrI	bromoiodomethane	InChI=1S/CH2BrI/c2-1-3/h1H2	TUDWMIUPYRKEFN-UHFFFAOYSA-N	BrCI		Methane, bromoiodo-
593668	C2H3I	Vinyl iodide	InChI=1S/C2H3I/c1-2-3/h2H,1H2	GHXZPUGJZVBLGC-UHFFFAOYSA-N	C=CI		Ethene, iodo-; Iodoethene
75036	C2H5I	Ethyl iodide	InChI=1S/C2H5I/c1-2-3/h2H2,1H3	HVTICUPFWKNHNG-UHFFFAOYSA-N	CCI		Ethane, iodo-; iodoethane
13709369	XeF2	Xenon difluoride	InChI=1S/F2Xe/c1-3-2		F[Xe]F
18283937	B4H10	Tetraborane(10)	InChI=1S/B4H10/c5-1-3(5)2(7-3)4(1,3,6-1)8-2/h3-4H,1-2H2	WEYOKDYZYYMRSQ-UHFFFAOYSA-N	[BH4]1[BH3]2[BH4][BH3]12		Boron hydride; Decahydrotetraborane; Tetraborane; arachno-tetraborane(10)
12184804	C4	Carbon tetramer	InChI=1S/C4/c1-2-4-3-1	ZJRINDVWMDPKLP-UHFFFAOYSA-N	[C]=C=C=[C]
12184804	C4+	Carbon tetramer cation	InChI=1S/C4/c1-3-4-2/q+1	SADAPCZSPKDXDW-UHFFFAOYSA-N	[C]=C=C=[C+]
460128	C4H2	Diacetylene	InChI=1S/C4H2/c1-3-4-2/h1-2H	LLCSWKVOHICRDD-UHFFFAOYSA-N	C#CC#C		Biethynyl; Biacetylene; 1,3-Butadiyne; Butadiyne; buta-1,3-diyne
460128	C4H2	Diacetylene	InChI=1S/C4H2/c1-3-4-2/h1-2H	LLCSWKVOHICRDD-UHFFFAOYSA-N	C#CC#C		Biethynyl; Biacetylene; 1,3-Butadiyne; Butadiyne; buta-1,3-diyne
460128	C4H2+	diacetlyene cation	InChI=1S/C4H2/c1-3-4-2/h1-2H/q+1	VHBKEPSJRWPSHQ-UHFFFAOYSA-N	[CH+]=[C]C#C
157391	C4H4	Tetrahedrane	InChI=1S/C4H4/c1-2-3(1)4(1)2/h1-4H/t1-,2+,3-,4+		C12C3C1C23		Tricyclo[1.1.0.02,​4]​butane
1120532	C4H4	cyclobutadiene	InChI=1S/C4H4/c1-2-4-3-1/h1-4H	HWEQKSVYKBUIIK-UHFFFAOYSA-N	C1=CC=C1
1120532	C4H4	cyclobutadiene	InChI=1S/C4H4/c1-2-4-3-1/h1-4H	HWEQKSVYKBUIIK-UHFFFAOYSA-N	C1=CC=C1
689974	C2H3CCH	1-Buten-3-yne	InChI=1S/C4H4/c1-3-4-2/h1,4H,2H2	WFYPICNXBKQZGB-UHFFFAOYSA-N	C=CC#C		Ethene, ethynyl-; Vinylacetylene; Buten-3-yne; But-1-en-3-yne; Ethynylethene; Monovinylacetylene; 1-Butyn-3-ene; 1-Butene-3-yne; Butenyne; 1-Butenyne; 3-Buten-1-yne
2873509	H2CCCCH2	Butatriene	InChI=1S/C4H4/c1-3-4-2/h1-2H2	WHVXVDDUYCELKP-UHFFFAOYSA-N	C=C=C=C		cumulene; 1,2,3-Butatriene
3100047	C4H6	1-Methylcyclopropene	InChI=1S/C4H6/c1-4-2-3-4/h2H,3H2,1H3	SHDPRTQPPWIEJG-UHFFFAOYSA-N	CC1=CC1		1-Methylcyclopropene; Cyclopropene, 1-methyl-; 1-methylcycloprop-1-ene
6142730	C4H6	Methylenecyclopropane	InChI=1S/C4H6/c1-4-2-3-4/h1-3H2	XSGHLZBESSREDT-UHFFFAOYSA-N	C=C1CC1
822355	C4H6	Cyclobutene	InChI=1S/C4H6/c1-2-4-3-1/h1-2H,3-4H2	CFBGXYDUODCMNS-UHFFFAOYSA-N	C1=CCC1		Cyclobutene
590192	CH2CCHCH3	1,2-Butadiene	InChI=1S/C4H6/c1-3-4-2/h4H,1H2,2H3	QNRMTGGDHLBXQZ-UHFFFAOYSA-N	C=C=CC		1,2-Butadiene; Allene, methyl-; Methylallene; buta-1,2-diene
503173	CH3CCCH3	2-Butyne	InChI=1S/C4H6/c1-3-4-2/h1-2H3	XNMQEEKYCVKGBD-UHFFFAOYSA-N	CC#CC		2-Butyne; But-2-yne; Crotonylene; Dimethylacetylene; butyne
106990	CH2CHCHCH2	1,3-Butadiene	InChI=1S/C4H6/c1-3-4-2/h3-4H,1-2H2	KAKZBPTYRLMSJV-UHFFFAOYSA-N	C=CC=C		α,γ-Butadiene; 1,3-Butadiene; (E)-CH2=CHCH=CH2; Biethylene; Bivinyl; Buta-1,3-dieen; Buta-1,3-dien; Buta-1,3-diene; Butadieen; Butadien; Butadiene; Divinyl; Erythrene; Pyrrolylene; trans-Butadiene; Vinylethylene; alpha,gamma-Butadiene; 1,3butadiene; trans-1,3-butadiene
106990	CH2CHCHCH2	1,3-Butadiene	InChI=1S/C4H6/c1-3-4-2/h3-4H,1-2H2	KAKZBPTYRLMSJV-UHFFFAOYSA-N	C=CC=C		α,γ-Butadiene; 1,3-Butadiene; (E)-CH2=CHCH=CH2; Biethylene; Bivinyl; Buta-1,3-dieen; Buta-1,3-dien; Buta-1,3-diene; Butadieen; Butadien; Butadiene; Divinyl; Erythrene; Pyrrolylene; trans-Butadiene; Vinylethylene; alpha,gamma-Butadiene; 1,3butadiene; trans-1,3-butadiene
107006	CHCCH2CH3	1-Butyne	InChI=1S/C4H6/c1-3-4-2/h1H,4H2,2H3	KDKYADYSIPSCCQ-UHFFFAOYSA-N	C#CCC		1-Butyne; Butyne-1; Ethyl acetylene, inhibited; Ethylacetylene; Ethylethyne; butyne; but-1-yne
16520211	CH3CHCHCH2	methylallyl radical	InChI=1S/C4H7/c1-3-4-2/h3-4H,1H2,2H3	CRPTXKKKIGGDBX-UHFFFAOYSA-N	[CH2]/C=C/C
16520211	CH3CHCHCH2	methylallyl radical	InChI=1S/C4H7/c1-3-4-2/h3-4H,1H2,2H3/b4-3+	CRPTXKKKIGGDBX-ONEGZZNKSA-N	[CH2]/C=C/C
106989	CH2CHCH2CH3	1-Butene	InChI=1S/C4H8/c1-3-4-2/h3H,1,4H2,2H3	VXNZUUAINFGPBY-UHFFFAOYSA-N	C=CCC		α-Butene; α-Butylene; 1-Butene; 1-Butylene; 1-C4H8; But-1-ene; Butene-1; Ethylethylene; butene; alpha-Butene; alpha-Butylene
115117	CH2C(CH3)CH3	1-Propene, 2-methyl-	InChI=1S/C4H8/c1-4(2)3/h1H2,2-3H3	VQTUBCCKSQIDNK-UHFFFAOYSA-N	C=C(C)C		1-Propene, 2-methyl-; γ-Butylene; 1,1-Dimethylethylene; 2-Methyl-1-propene; 2-Methylpropene; 2-Methylpropene-isobutylene; Isobutene; Isobutylene; iso-C4H8; Isopropylidenemethylene; Liquefied petroleum gas; Methylpropene; Propene, 2-methyl-; gamma-Butylene; 2-methylprop-1-ene
590181	CH3CHCHCH3	2-Butene, (Z)-	InChI=1S/C4H8/c1-3-4-2/h3-4H,1-2H3/b4-3-	IAQRGUVFOMOMEM-ARJAWSKDSA-N	C/C=C\C		2-Butene, (Z)-; (Z)-2-Butene; (Z)-2-C4H8; cis-1,2-Dimethylethylene; cis-2-Butene; cis-Butene; cis-Butylene; Dimethylethylene; butene; 2-butene; (Z)-but-2-ene
594116	C4H8	methylcyclopropane	InChI=1S/C4H8/c1-4-2-3-4/h4H,2-3H2,1H3	VNXBKJFUJUWOCW-UHFFFAOYSA-N	CC1CC1
624646	CH3CHCHCH3	2-Butene, (E)-	InChI=1S/C4H8/c1-3-4-2/h3-4H,1-2H3/b4-3+	IAQRGUVFOMOMEM-ONEGZZNKSA-N	C/C=C/C		2-Butene, (E)-; (E)-2-Butene; (E)-2-C4H8; 2-trans-Butene; trans-1,2-Dimethylethylene; trans-2-Butene; trans-Butene; butene; 2-butene; (E)-but-2-ene
593908	B(CH3)3	trimethylborane	InChI=1S/C3H9B/c1-4(2)3/h1-3H3	WXRGABKACDFXMG-UHFFFAOYSA-N	CB(C)C		trimethylboron
1605738	C(CH3)3	Tert-butyl radical	InChI=1S/C4H9/c1-4(2)3/h1-3H3	IIVWHGMLFGNMOW-UHFFFAOYSA-N	C[C](C)C		tert-Butyl radical; tert-C4H9; 2-Methylpropan-2-yl
4630459	CH2CH(CH3)2	Isobutyl radical	InChI=1S/C4H9/c1-4(2)3/h4H,1H2,2-3H3	KTOQRRDVVIDEAA-UHFFFAOYSA-N	[CH2]C(C)C		1-Propyl radical, 2-methyl-; Isobutyl radical; iso-C4H9; 2-Methylpropan-1-yl
2348552	CH3CHCH2CH3	2-Butyl radical	InChI=1S/C4H9/c1-3-4-2/h3H,4H2,1-2H3	ULOIAOPTGWSNHU-UHFFFAOYSA-N	C[CH]CC		2-Butyl radical; sec-Butyl radical; sec-C4H9; butan-2-yl
106978	CH3CH2CH2CH3	Butane	InChI=1S/C4H10/c1-3-4-2/h3-4H2,1-2H3	IJDNQMDRQITEOD-UHFFFAOYSA-N	CCCC		Butane; Butanen; Butani; Diethyl; Freon 600; Liquefied petroleum gas; LPG; Methylethylmethane; n-Butane; n-C4H10
106978	CH3CH2CH2CH3	Butane	InChI=1S/C4H10/c1-3-4-2/h3-4H2,1-2H3	IJDNQMDRQITEOD-UHFFFAOYSA-N	CCCC		Butane; Butanen; Butani; Diethyl; Freon 600; Liquefied petroleum gas; LPG; Methylethylmethane; n-Butane; n-C4H10
75285	CH3CH(CH3)CH3	Isobutane	InChI=1S/C4H10/c1-4(2)3/h4H,1-3H3	NNPPMTNAJDCUHE-UHFFFAOYSA-N	CC(C)C		1,1-Dimethylethane; 2-Methylpropane; A 31; i-Butane; Isobutane; Isobutane mixtures; iso-C4H10; Liquefied petroleum gas; Propane, 2-methyl-; R 600a; tert-Butane; Trimethylmethane
157335	C4H6	Bicyclo[1.1.0]butane	InChI=1S/C4H6/c1-3-2-4(1)3/h3-4H,1-2H2	LASLVGACQUUOEB-UHFFFAOYSA-N	[C@@H]12C[C@@H]1C2		Bicyclo[1.1.0]butane
287230	C4H8	cyclobutane	InChI=1S/C4H8/c1-2-4-3-1/h1-4H2	PMPVIKIVABFJJI-UHFFFAOYSA-N	C1CCC1		Cyclobutane; Tetramethylene
460195	C2N2	Cyanogen	InChI=1S/C2N2/c3-1-2-4	JMANVNJQNLATNU-UHFFFAOYSA-N	N#CC#N		Carbon nitride; Carbon nitride (C2N2); Cyanogen; Cyanogen (C2N2); Cyanogen gas; Cyanogene; Dicyan; Dicyanogen; Ethanedinitrile; NCCN; Nitriloacetonitrile; Oxalic acid dinitrile; Oxalic nitrile; Oxalonitrile; Oxalyl cyanide; Prussite
460195	C2N2+	Cyanogen cation	InChI=1S/C2N2/c3-1-2-4/q+1	NPEMKTLMDYAXKQ-UHFFFAOYSA-N	N#[C+]C#N
26134623	Li3N	trilithium nitride	InChI=1S/3Li.N	IDBFBDSKYCUNPW-UHFFFAOYSA-N	[Li]N([Li])[Li]
26134623	Li3N	trilithium nitride	InChI=1S/3Li.N	IDBFBDSKYCUNPW-UHFFFAOYSA-N	[Li]N([Li])[Li]
1070719	HCCCN	Cyanoacetylene	InChI=1S/C3HN/c1-2-3-4/h1H	LNDJVIYUJOJFSO-UHFFFAOYSA-N	C#CC#N		Propiolonitrile; Cyanaethylene; Cyanoethyne; Propynenitrile; 2-Propynenitrile
1070719	HCCCN+	Cyanoacetylene cation	InChI=1S/C3HN/c1-2-3-4/h1H/q+1	HWYNWVPZAQTDKQ-UHFFFAOYSA-N	[CH+]=C=C=[N]
20815456	HNCCNH	Ethenediimine	InChI=1S/C2H2N2/c3-1-2-4/h3-4H	RUTRGUOJQDNDCQ-UHFFFAOYSA-N	N=C=C=N		Diiminoethylene; Vinylidenediimine
43730263	H2CNCN	cyanamide, methylene	InChI=1S/C2H2N2/c1-4-2-3/h1H2		C=NC#N		N-cyanomethanimine
624908	CH3N3	methyl azide	InChI=1S/CH3N3/c1-3-4-2/h1H3	PBTHJVDBCFJQGG-UHFFFAOYSA-N	CN=[N+]=[N-]
107131	C3H3N	acrylonitrile	InChI=1S/C3H3N/c1-2-3-4/h2H,1H2	NLHHRLWOUZZQLW-UHFFFAOYSA-N	C=CC#N		2-Propenenitrile; Acritet; Acrylnitril; Acrylon; Acrylonitrile; Acrylonitrile monomer; Acrylonitrile, inhibited; Akrylonitril; Akrylonitryl; Carbacryl; Cianuro di vinile; Cyanoethene; Cyanoethylene; Cyanure de vinyle; ENT 54; Fumigrain; Miller's fumigrain; Nitrile acrilico; Nitrile acrylique; Propenenitrile; TL 314; VCN; Ventox; Vinylkyanid; Vinyl cyanide
107131	C3H3N+	acrylonitrile cation	InChI=1S/C3H3N/c1-2-3-4/h2H,1H2/q+1	ZEKYDXZLIPYKBD-UHFFFAOYNA-N	[CH2][CH+]C#N
540614	NH2CH2CN	Aminoacetonitrile	InChI=1S/C2H4N2/c3-1-2-4/h1,3H2	DFNYGALUNNFWKJ-UHFFFAOYSA-N	NCC#N		Acetonitrile, amino-; AAN; 2-Aminoacetonitrile; Cyanomethylamine; Glycinenitrile; Glycinonitrile; α-Aminoacetonitrile
4403547	NH2CCNH2	Diaminoacetylene	InChI=1S/C2H4N2/c3-1-2-4/h3-4H2	PGAFCJWTBHYLDN-UHFFFAOYSA-N	NC#CN		1,​2-​Ethynediamine
4403547	NH2CCNH2	Diaminoacetylene	InChI=1S/C2H4N2/c3-1-2-4/h3-4H2		NC#CN		1,​2-​Ethynediamine
43732838	CH3NHN2+	methyl azide, protonated	InChI=1S/CH4N3/c1-3-4-2/h3H,1H3/q+1	ZIWHHHOGLBNHLH-UHFFFAOYSA-N	CN[N+]#N		Active Server Pages error 'ASP 0113' Script timed out /inchix.asp The maximum amount of time for a script to execute was exceeded. You can change this limit by specifying a new value for the property Server.ScriptTimeout or by changing the value in the IIS administration tools.