National Institute of Standards and Technology

Computational Chemistry Comparison and Benchmark DataBase
Release 22	May 2022
NIST Standard Reference Database 101

I	Introduction
II	Experimental data
III	Calculated data
IV	Data comparisons
V	Cost comparisons
VI	Input and output files
VII	Tutorials and Units
VIII	Links to other sites
IX	Feedback
X	Older CCCBDB versions
XII	Geometries
XIII	Vibrations
XIV	Reaction data
XV	Entropy data
XVI	Bibliographic data
XVII	Ion data
XVIII	Bad calculations
XIX	Index of properties
XX	H-bond dimers
XXI	Oddities

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III.F.1. (I.A.4.)

List of which calculations are completed at QCISD(T) /cc-pV(T+d)Z

Jump to calculations not yet done

count	Species	Name	State	Conformation
1	D	Deuterium atom	1S	Kh
2	H	Hydrogen atom	1S	Kh
3	H+	Hydrogen atom cation		Kh
4	D2	Deuterium diatomic	1Σg	D∞h
5	H2	Hydrogen diatomic	1Σg	D∞h
6	H2-	hydrogen diatomic anion	2Σu+	D∞h
7	HD	Deuterium hydride	1Σg	D∞h
8	He2+	helium diatomic cation	2Σu	D∞h
9	LiH-	lithium hydride anion	2Σ	C∞v
10	LiH+	lithium hydride cation	2Σ	C∞v
11	NaH-	sodium hydride anion	2Σ	C∞v
12	NaH+	sodium hydride cation	2Σ	C∞v
13	BeH-	berylium monohydride anion	1Σ	C∞v
14	BeH+	beryllium monohydride cation	1Σ	C∞v
15	MgH-	magnesium monohydride anion	1Σ	C∞v
16	MgH+	magnesium monohydride cation	1Σ	C∞v
17	B	Boron atom	2P	Kh
18	BH	Boron monohydride	1Σ	C∞v
19	BH-	boron monohydride anion	2Π	C∞v
20	BH+	boron monohydride cation	2Σ	C∞v
21	BH2	boron dihydride	2A1	C2v
22	BH3	boron trihydride	1A1'	D3h
23	AlH3	aluminum trihydride	1A1'	D3h
24	C	Carbon atom	3P0	Kh
25	Si	Silicon atom	3P	Kh
26	CH	Methylidyne	2Π1/2	C∞v
27	CH-	methylidyne anion	3Σ	C∞v
28	CH+	Methylidyne cation	1Σ	C∞v
29	CH2	Methylene	3B1	C2v
30	CH2	Methylene	1A1	C2v
31	CH2-	methylene anion	2B1	C2v
32	CH2+	methylene cation	2A1	C2v
33	SiH2	silicon dihydride	1A1	C2v
34	SiH2	silicon dihydride	3B1	C2v
35	CH3	Methyl radical	2A1	D3h
36	CH3-	methyl anion	1A1	C3v
37	SiH3	Silyl radical	2A1	C3v
38	CH4	Methane	1A1	Td
39	SiH4	Silane	1A1	Td
40	P	Phosphorus atom	4S	Kh
41	NH	Imidogen	3Σ-	C∞v
42	NH	Imidogen	1Σ+	C∞v
43	NH-	Imidogen anion	2Π	C∞v
44	NH+	imidogen cation	2Π	C∞v
45	PH	phosphorus monohydride	1Σ+	C∞v
46	ND2	Amidogen-d2	2B1	C2v
47	NH2	Amino radical	2B1	C2v
48	NH2-	amino anion	1A1	C2v
49	ND3	Ammonia-d3	1A1	C3v
50	NH3	Ammonia	1A1	C3v
51	PH3	Phosphine	1A1	C3v
52	PH4+	phosphonium cation
53	O	Oxygen atom	3S	Kh
54	S	Sulfur atom	3P	Kh
55	DO	Hydroxyl-d	2Π	C∞v
56	OH	Hydroxyl radical	2Π	C∞v
57	OH-	hydroxide anion	1Σ	C∞v
58	OH+	hydoxyl cation	3Σ	C∞v
59	OH+	hydoxyl cation	1Σ	C∞v
60	HS	Mercapto radical	2Π	C∞v
61	D2O	Deuterium oxide	1A1	C2v
62	H2O	Water	1A1	C2v
63	H2O-	water anion	2A1	C2v
64	H2O+	water cation	2B1	C2v
65	HDO	Water-d1	1A1	C2v
66	D2S	Hydrogen sulfide-d2	1A1	C2v
67	H2S	Hydrogen sulfide	1A1	C2v
68	H2S+	Hydrogen sulfide cation	2B1	C2v
69	H3O+	hydronium cation	1A1	C3v
70	H3S+	Sulfonium cation	1A1	C3v
71	F	Fluorine atom	2P	Kh
72	Cl	Chlorine atom	2P	Kh
73	DF	Hydrofluoric acid-d	1Σ	C∞v
74	HF	Hydrogen fluoride	1Σ	C∞v
75	HF-	hydrogen fluoride anion	2Σ	C∞v
76	HF+	hydrogen fluoride cation	2Π	C∞v
77	HCl	Hydrogen chloride	1Σ	C∞v
78	HCl+	hydrogen chloride cation	2Π	C∞v
79	H2Cl+	dihydrogen monochloride cation	1A1	C2v
80	Ne	Neon atom	1S	Kh
81	NeH+	neon hydrogen cation	1Σ	C∞v
82	Li2-	lithium diatomic anion	2Σu	D∞h
83	NaLi	lithium sodium	1Σ	C∞v
84	NaLi-	lithium sodium anion	2Σ	C∞v
85	NaLi+	lithium sodium cation	2Σ	C∞v
86	Na2-	sodium diatomic anion	2Σu	D∞h
87	Na2+	sodium diatomic cation	2Σg	D∞h
88	Be2-	Beryllium diatomic anion	2Πu	D∞h
89	Be2+	Beryllium diatomic cation	2Σu	D∞h
90	Mg2-	magnesium diatomic anion	2ΠU	D∞h
91	Mg2+	magnesium diatomic cation	2Σu	D∞h
92	B2	Boron diatomic	1Σg	D∞h
93	B2	Boron diatomic	5Σu	D∞h
94	B2-	Boron diatomic anion	4Σg	D∞h
95	BAl	Boron Aluminum	3Σ	C∞v
96	BC-	boron monocarbide anion	1Σg+	C∞v
97	AlC	Aluminum carbide	4Σ	C∞v
98	C2	Carbon diatomic	3Πu	D∞h
99	C2-	carbon diatomic anion	2Σg	D∞h
100	C2+	carbon diatomic cation	2Π	D∞h
101	SiC	silicon monocarbide	3Σ	C∞v
102	SiC	silicon monocarbide	1Σ	C∞v
103	C2H2+	acetylene cation	2Πu	D∞h
104	Si2H6	disilane	1Eu	D3d
105	BeN-	Beryllium mononitride anion	1Σ	C∞v
106	BN-	boron nitride anion	2Σ	C∞v
107	BN	boron nitride	3Π	C∞v
108	BN	boron nitride	1Σ	C∞v
109	BN+	boron nitride cation	2Π	C∞v
110	AlN	Aluminum nitride	3Πi	C∞v
111	CN-	cyanide anion	1Σ	C∞v
112	CN+	Cyano cation	1Σ	C∞v
113	SiP	Silicon monophosphide	2Π	C∞v
114	N2-	nitrogen diatomic anion	2Πg	D∞h
115	P2	Phosphorus diatomic	1Σg	D∞h
116	HCN	Hydrogen cyanide	1Σ	C∞v
117	HCN+	hydrogen cyanide cation	2Π	C∞v
118	N2H2	(E)-diazene	1Ag	C2h
119	CH2PH	Phosphaethene	1A'	Cs
120	CH2NH2+	methyleneamine cation	1A1	C2v
121	BH3PH3	borane phosphine
122	LiO+	lithium oxide cation	3Σ	C∞v
123	LiO+	lithium oxide cation	1Σ	C∞v
124	LiS	Lithium monosulfide	2Π	C∞v
125	NaO+	sodium oxide cation	3Σ	C∞v
126	BeO-	Beryllium monoxide anion	2Σ	C∞v
127	BeO+	Beryllium monoxide cation	2Π	C∞v
128	MgO-	magnesium oxide anion	2Σ	C∞v
129	MgO+	magnesium oxide cation	2Π	C∞v
130	CaS	Calcium sulfide	1Σ	C∞v
131	BO-	boron monoxide anion	1Σ	C∞v
132	BO+	boron monoxide cation	1Σ	C∞v
133	CO-	carbon monoxide anion	2Π	C∞v
134	CO+	carbon monoxide cation	2Σ	C∞v
135	GeO	Germanium monoxide	1Σ	C∞v
136	SiSe	Silicon Monoselenide
137	NO-	nitric oxide anion	3Σ	C∞v
138	NO-	nitric oxide anion	1Δ	C∞v
139	PO	Phosphorus monoxide	2Π	C∞v
140	PS	phosphorus sulfide	2Σ	C∞v
141	O2-	oxygen diatomic anion	2Π	D∞h
142	SO	Sulfur monoxide	3Σ	C∞v
143	SO	Sulfur monoxide	1Σ	C∞v
144	S2	Sulfur diatomic	3Σg	D∞h
145	S2+	sulfur diatomic cation	2Π	D∞h
146	Se2	Selenium diatomic	3Σg	D∞h
147	HO2	Hydroperoxy radical	2A"	Cs
148	HSO+	Sulfur Monoxide, S-protonated
149	SOH	Sulfur Hydroxide
150	SOH+	Sulfur Monoxide, protonated
151	H2CO+	formaldehyde cation	2B2	C2v
152	H2CS	Thioformaldehyde	1A1	C2v
153	H2CSe	Selenoformaldehyde
154	H2S2	Disulfane	1A	C2
155	H2S2+	hydrogen disulfide cation	2Bg	C2h
156	CH2OH+	hydroxymethyl cation	1A'	Cs
157	H2CSH+	Thioformaldehyde, protonated	1A'	Cs
158	H2POH	Phosphinous acid	1A1'	CS trans
159	H2POH	Phosphinous acid	1A1'	CS cis
160	H3PO	Phosphine oxide	1A1	C3v
161	CH3SH	Methanethiol	1A'	Cs
162	CH3SH2+	protonated methylsulfide	1A'	Cs
163	LiCl	lithium chloride	1Σ	C∞v
164	NaF-	sodium fluoride anion	2Σ	C∞v
165	NaF+	sodium fluoride cation	2Σ	C∞v
166	LiF-	lithium fluoride anion	2Σ	C∞v
167	LiF+	lithium fluoride cation	2Π	C∞v
168	BeF-	Beryllium monofluoride anion	1Σ	C∞v
169	BeF+	Beryllium monofluoride cation	1Σ	C∞v
170	MgF-	magnesium fluoride anion	1Σ	C∞v
171	MgF+	magnesium fluoride cation	1Σ	C∞v
172	BF-	Boron monofluoride anion	2Π	C∞v
173	BF+	Boron monofluoride cation	2Σ	C∞v
174	AlCl	Aluminum monochloride	1Σ	C∞v
175	CF-	carbon monofluoride anion	3Σ	C∞v
176	CF-	carbon monofluoride anion	1Σ	C∞v
177	CF+	carbon monofluoride cation	1Σ	C∞v
178	SiF	silicon monofluoride	2Π	C∞v
179	SiF+	silicon monofluoride cation	1Σ	C∞v
180	NF	nitrogen fluoride	1Σ	C∞v
181	NF-	nitrogen monofluorine anion	2Π	C∞v
182	NF+	nitrogen monofluoirde cation	2Π	C∞v
183	NCl	nitrogen monochloride	3Σ	C∞v
184	FO-	flourine oxide anion	1Σ	C∞v
185	FO+	fluorine monoxide cation	3Σ	C∞v
186	ClO	Monochlorine monoxide	2Π	C∞v
187	SF	Monosulfur monofluoride	2Π	C∞v
188	SF+	sulfur monofluoride cation	3Σ	C∞v
189	SCl	sulfur monochloride	2Π	C∞v
190	SCl+	sulfur monochloride cation	3Σg	C∞v
191	SBr	Sulfur monobromide radical
192	F2-	flourine diatomic anion	2Σu	D∞h
193	F2+	flourine diatomic cation	2Πg	D∞h
194	ClF	Chlorine monofluoride	1Σ+	C∞v
195	Cl2-	chlorine diatomic anion	2Σu	D∞h
196	Cl2+	chlorine diatomic cation	2Πg	D∞h
197	HOCl	hypochlorous acid	1A'	Cs
198	CH3Cl	Methyl chloride	1A1	C3v
199	SiH3Cl	chlorosilane	1A1	C1
200	Si3H8	trisilane
201	Li2O	dilithium oxide	1Σg	D∞h
202	Li2S	dilithium sulfide	1ΣG	D∞h
203	Li2S	dilithium sulfide	1A1	C2v
204	NNS	Nitrogen sulfide	1Σ	C∞v
205	OCS	Carbonyl sulfide	1Σ	C∞v
206	SiS2	Silicon disulfide	1ΣG	D∞h
207	NSO	sulfinyl amidogen
208	SNO	Nitrogen oxide sulfide
209	O3	Ozone	1A1	Cs
210	SO2	Sulfur dioxide	1A1	C2v
211	S3	Sulfur trimer
212	S3+	Sulfur trimer cation	2B2	C2v
213	HOCO	Hydrocarboxyl radical	1A'	cis
214	HOCO	Hydrocarboxyl radical	1A'	trans
215	HCCOH	ethynol	1A'	Cs
216	CH2CS	Thioketene
217	HSSSH	trisulfane	1A	C2
218	HSSSH	trisulfane	1A'	Cs
219	C2H4S	Thiirane	1A1	C2v
220	CH3CHS	Thioacetaldehyde	1A'	C1
221	CH3SSH	Hydrogen methyl disulfide
222	CH3CH2SH	ethanethiol	1A'	Cs
223	FNS	Thionitrosyl fluoride	1A'	Cs
224	FSN	Thiazyl fluoride	1A'	Cs
225	OPCl	Phosphorus oxychloride
226	GeCl2	Germanium dichloride	1A1	C2v
227	OClO	Chlorine dioxide	2B1	D∞h
228	ClSO	Sulfur chloride oxide	2A"	Cs
229	FClO	chlorosyl fluoride	1A'	Cs
230	ClOF	Chlorine hypofluorite	1A'	Cs
231	SF2	sulfur difluoride	1A1	C2v
232	SCl2	Sulfur dichloride	1A1	C2v
233	SeCl2	Selenium Dichloride
234	SBr2	Sulfur dibromide
235	SeBr2	Selenium dibromide
236	CH2F2	Methane, difluoro-	1A1	C2v
237	S2N2	Disulfur dinitride	1AG	D2h
238	CS3--	Carbonotrithioate
239	SO3	Sulfur trioxide	1A1'	D3h
240	S4	Sulfur tetramer
241	S4	Sulfur tetramer
242	S4	Sulfur tetramer
243	H3AlO3	Aluminum hydroxide
244	CH3CSNH2	Ethanethioamide
245	C2F2	difluoroacetylene	1Σg	D∞h
246	Cl2CS	Thiophosgene	1A1	C2v
247	AlF3	Aluminum trifluoride	1A1'	D3h
248	ClO2F	Chloryl fluoride	1A'	Cs
249	F2SO	Thionyl Fluoride	1A'	Cs
250	SSCl2	Thiothionyl chloride
251	SF3	Sulfur trifluoride	2A'	Cs
252	ClF3	Chlorine trifluoride	1A1'	D3h
253	ClF3	Chlorine trifluoride	1A1	C2v
254	HClO3	Chloric Acid	1A	C1
255	C2H6O2S	Dimethyl sulfone	1A1	C2v
256	CF2Cl2	difluorodichloromethane	1A1	C2v
257	SF4	Sulfur tetrafluoride	1A1	C2v
258	HClO4	perchloric acid	1A	Cs
259	SiH3CCl3	(trichloromethyl)silane	1A1	C3v
260	SiF5-	silicon pentafluoride anion
261	SOF4	Sulfur tetrafluoride oxide	1A1	C2v
262	PF5	Phosphorus pentafluoride	1A1'	D3h
263	CHCl2CHCl2	Ethane, 1,1,2,2-tetrachloro-
264	PF6-	Hexafluorophosphate ion	1A1G	Oh
265	SF5Cl	sulfur chloropentafluoride	1A1	C4v
266	Al2Cl6	Aluminum, di-μ-chlorotetrachlorodi-	1AG	D2h

Species NOT done yet

count	Species	Name	file name	problem
1	D-	Deuterium atom anion	d-
2	D+	Deuterium atom cation	d+
3	H-	Hydrogen atom anion	h-
4	H2+	Hydrogen cation	h2+
5	H3+	hydrogen trimer cation	h3+
6	He	Helium atom	he
7	He-	Helium atom anion	he-
8	He+	Helium atom cation	he+
9	HeH	Helium hydride	heh
10	HeH+	Helium hydride cation	heh+
11	Li	Lithium atom	li
12	Li-	Lithium atom anion	li-
13	Li+	Lithium atom cation	li+
14	Na	Sodium atom	na
15	Na-	Sodium atom anion	na-
16	Na+	Sodium atom cation	na+
17	K	Potassium atom	k
18	K-	Potassium atom anion	k-
19	K+	Potassium atom cation	k+
20	Cu	Copper atom	cu
21	Cu-	Copper atom anion	cu-
22	Cu+	Copper atom cation	cu+
23	LiH	Lithium Hydride	lih
24	NaH	sodium hydride	nah
25	KH	Potassium hydride	kh
26	KH+	Potassium hydrogen cation	kh+
27	CuH	Copper monohydride	cuh
28	Be	Beryllium atom	be
29	Be-	Beryllium atom anion	be-
30	Be+	Beryllium atom cation	be+
31	Mg	Magnesium atom	mg
32	Mg-	Magnesium atom anion	mg-
33	Mg+	Magnesium atom cation	mg+
34	Ca	Calcium atom	ca
35	Ca-	Calcium atom anion	ca-
36	Ca+	Calcium atom cation	ca+
37	Zn	Zinc atom	zn
38	Zn-	Zinc atom anion	zn-
39	Zn+	Zinc atom cation	zn+
40	BeH	beryllium monohydride	beh
41	MgH	magnesium monohydride	mgh
42	CaH	Calcium monohydride	cah
43	CaH+	Calcium monohydride cation	cah+
44	TiH	Titanium monohydride	tih
45	ZnH	Zinc monohydride	znh
46	ZnH+	Zinc, protonated	znh+
47	BeH2	beryllium dihydride	beh2
48	BeH2+	Beryllium dihydride cation	beh2+
49	MgH2	magnesium dihydride	mgh2
50	CaH2	Calcium Hydride	cah2
51	ZnH2	Zinc hydride	znh2
52	B-	Boron atom anion	b-
53	B+	Boron atom cation	b+
54	Al	Aluminum atom	al
55	Al-	Aluminum atom anion	al-
56	Al+	Aluminum atom cation	al+
57	Sc	Scandium atom	sc
58	Sc+	Scandium cation	sc+
59	Ga	Gallium atom	ga
60	Ga-	Gallium atom anion	ga-
61	Ga+	Gallium atom cation	ga+
62	AlH	aluminum monohydride	alh
63	AlH-	aluminum monohydride anion	alh-
64	AlH+	aluminum monohydride cation	alh+
65	ScH	Scandium monohydride	sch
66	ScH+	Scandium monohydride cation	sch+
67	GaH	Gallium monohydride	gah
68	GaH+	Gallium monohydride cation	gah+
69	BH2-	boron dihydride anion	bh2-
70	BH2+	Boron dihydride cation	bh2+
71	AlH2	aluminum dihydride	alh2
72	AlH2-	aluminum dihydride anion	alh2-
73	AlH2+	aluminum dihydride cation	alh2+
74	BH3-	boron trihydride anion	bh3-
75	BH3+	boron trihydride cation	bh3+
76	AlH3-	aluminum trihydride anion	alh3-
77	AlH3+	aluminum trihydride cation	alh3+
78	ScH3	Scandium trihydride	sch3
79	GaH3	Gallium trihydride	gah3
80	BH4	borohydride	bh4
81	BH4-	borohydride anion	bh4-
82	AlH4-	Aluminum tetrahydride anion	alh4-
83	C-	Carbon atom anion	c-
84	C+	Carbon atom cation	c+
85	Si-	Silicon atom anion	si-
86	Si+	Silicon atom cation	si+
87	Ti	Titanium atom	ti
88	Ti-	Titanium atom anion	ti-
89	Ti+	Titanium atom cation	ti+
90	Ge	Germanium atom	ge
91	Ge-	Germanium anion	ge-
92	Ge+	Germanium cation	ge+
93	Sn	Tin atom	sn
94	Sn+	Tin cation	sn+
95	SiH	Silylidyne	sih
96	SiH-	silicon monohydride anion	sih-
97	SiH+	silicon monohydride cation	sih+
98	GeH	germylidene	geh
99	GeH+	Germaniun monohyrdide cation	geh+
100	SiH2-	silicon dihydride anion	sih2-
101	SiH2+	silicon dihydride cation	sih2+
102	GeH2	germylene	geh2
103	GeH2-	germylene anion	geh2-
104	CH3+	methyl cation	ch3+
105	SiH3-	Silyl anion	sih3-
106	SiH3+	Silyl cation	sih3+
107	GeH3	Germyl radical	geh3
108	GeH3+	germyl cation	geh3+
109	CD4	methane-d4	cd4
110	CH2D2	methane-d2	ch2d2
111	CH3D	methane-d	ch3d
112	CH4-	Methane anion	ch4-
113	CH4+	Methane cation	ch4+
114	CHD3	methane-d3	chd3
115	SiH2D2	silane-d2	sih2d2
116	SiH4+	Silane cation	sih4+
117	GeH4	Germane	geh4
118	SnH4	Stannane	snh4
119	SiH5+	Silane, protonated	sih5+
120	N	Nitrogen atom	n
121	N-	Nitrogen atom anion	n-
122	N+	Nitrogen atom cation	n+
123	P-	Phosphorus atom anion	p-
124	P+	Phosphorus atom cation	p+
125	V	Vanadium atom	v
126	V+	Vanadium atom cation	v+
127	As	Arsenic atomic	as
128	As-	Arsenic anion	as-
129	As+	Arsenic cation	as+
130	Sb	Antimony atom	sb
131	PH	phosphorus monohydride	ph
132	PH-	phosphorus monohydride anion	ph-
133	PH+	phosphorus monohydride cation	ph+
134	AsH	Arsenic monohydride	ash
135	AsH+	Arsenic monohydride cation	ash+
136	SbH	Antimony monohydride	sbh
137	NH2+	Amino cation	nh2+
138	PH2	Phosphino radical	ph2
139	PH2-	Phosphino anion	ph2-
140	PH2+	Phosphino cation	ph2+
141	AsH2	Arsenic dihydride	ash2
142	AsH2+	Arsenic dihydride cation	ash2+
143	NH3-	Ammonia anion	nh3-
144	NH3+	ammonia cation	nh3+
145	PH3+	Phosphine cation	ph3+
146	AsH3	Arsine	ash3
147	AsH3+	Arsine cation	ash3+
148	SbH3	Stibine	sbh3
149	AsH4+	Arsonium	ash4+
150	NH4	Ammonium radical	nh4
151	NH4+	ammonium cation	nh4+
152	PH4	Phosphoranyl radical	ph4
153	O-	Oxygen atom anion	o-
154	O+	Oxygen atom cation	o+
155	S-	Sulfur atom anion	s-
156	S+	Sulfur atom cation	s+
157	Cr	Chromium atom	cr
158	Se	Selenium atom	se
159	Se-	Selenium atom anion	se-
160	Se+	Selenium atom cation	se+
161	Te	Tellurium atom	te
162	Te+	Tellurium atom cation	te+
163	DS	Mercapto-d	ds
164	HS-	mercapto anion	sh-
165	HS+	sulfur monohydride cation	sh+
166	CrH	Chromium hydride	crh
167	CrH+	Chromium hydride cation	crh+
168	HSe	Selenium monohydride	hse
169	HSe-	selenium monohydride anion	hse-
170	HSe+	selenium monohydride cation	hse+
171	TeH	Telluryl radical	teh
172	H2S-	Hydrogen sulfide anion	h2s-
173	H2Se	Hydrogen selenide	h2se
174	H2Se+	Hydrogen selenide cation	h2se+
175	H2Te	Hydrogen Telluride	h2te
176	H3Se+	Hydrogen Selenide, protonated	h3se+
177	F-	Fluorine atom anion	f-
178	F+	Fluorine atom cation	f+
179	Cl-	Chlorine atom anion	cl-
180	Cl+	Chlorine atom cation	cl+
181	Mn	Manganese atom	mn
182	Br	Bromine atom	br
183	Br-	Bromine atom anion	br-
184	Br+	Bromine atom cation	br+
185	I	Iodine atom	iodine
186	I-	Iodine atom anion	iodine-
187	I+	Iodine atom cation	iodine+
188	DCl	Hydrochloric acid-d	dcl
189	HCl-	hydrogen chloride anion	hcl-
190	HBr	hydrogen bromide	hbr
191	HBr-	hydrogen bromide anion	hbr-
192	HBr+	hydrogen bromide cation	hbr+
193	HI	Hydrogen iodide	hi
194	HI+	Hydrogen iodide cation	hi+
195	H2F+	dihydrogen fluoride cation	h2f+
196	H2Br+	protonated hydrogen bromide	h2br+
197	H2I+	Iodonium	h2i+
198	Ne-	Neon atom anion	ne-
199	Ne+	Neon atom cation	ne+
200	Ar	Argon atom	ar
201	Ar-	Argon atom anion	ar-
202	Ar+	Argon atom cation	ar+
203	Fe	Iron atom	fe
204	Kr	Krypton atom	kr
205	Kr+	Krypton cation	kr+
206	Xe	Xenon atom	xe
207	HeLi+	Helium Lithium cation	heli+
208	NeH	neon hydrogen	neh
209	ArH+	Argon hydride cation	arh+
210	KrH+	Protonated Krypton	krh+
211	XeH+	Xenon, protonated	xeh+
212	H2Ar	H2 Ar dimer	h2ar
213	Co	Cobalt atom	cobalt
214	Ni	Nickel atom	ni
215	Li2	Lithium diatomic	li2
216	Li2+	lithium diatomic cation	li2+
217	LiK	Lithium Potassium	lik
218	Na2	Sodium diatomic	na2
219	NaK	Sodium Potassium	nak
220	NaK+	Sodium Potassium diatomic cation	nak+
221	K2	Potassium diatomic	k2
222	Cu2	Copper diatomic	cu2
223	LiBe	Lithium Beryllium	libe
224	LiMg	Lithium magnesium	limg
225	NaBe	Sodium Beryllium	nabe
226	NaMg	Sodium Magnesium	namg
227	Be2	Beryllium diatomic	be2
228	BeMg	Beryllium Magnesium	bemg
229	Mg2	Magnesium diatomic	mg2
230	Ca2	Calcium diatomic	ca2
231	LiB	Lithium boride	lib
232	LiAl	Lithium Aluminum	lial
233	NaAl	Sodium aluminum	naal
234	BeB	Beryllium monoboride	beb
235	B2	Boron diatomic	b2
236	B2+	Boron diatomic cation	b2+
237	Al2	Aluminum diatomic	al2
238	Al2-	aluminum diatomic anion	al2-
239	Al2+	aluminum diatomic cation	al2+
240	BGa	Boron Gallium	bga
241	AlGa	Aluminum Gallium	alga
242	Ga2	Gallium diatomic	ga2
243	HBBH	Diborane(2)	hbbh
244	LiBH4	Lithium borohydride	libh4
245	B2H4	Diborane(4) D2d	b2h4
246	HBHHBH	Diborane(4) C2V	hbhhbh
247	B2H6	Diborane	b2h6
248	B2H6+	Diborane cation	b2h6
249	Al2H6	dialane	al2h6
250	Ga2H6	digallane	ga2h6
251	LiC	Lithium Carbide	lic
252	BeC	Beryllium Carbide	bec
253	CaC	Calcium monocarbide	cac
254	BC	boron monocarbide	bc
255	BC-	boron monocarbide anion	bc-
256	BC+	boron monocarbide cation	bc+
257	BSi	Boron silicide	bsi
258	C2	Carbon diatomic	c2
259	C2+	carbon diatomic cation	c2+
260	SiC-	silicon monocarbide anion	sic-
261	SiC+	silicon monocarbide cation	sic+
262	Si2	Silicon diatomic	si2
263	Si2-	silcon diatomic anion	si2-
264	Si2+	silcon diatomic cation	si2+
265	GeC	Germanium monocarbide	gec
266	SiGe	Silicon Germanium	sige
267	Ge2	Germanium diatomic	ge2
268	C2H	Ethynyl radical	c2h
269	C2H-	Ethynyl anion	c2h-
270	C2H+	Ethynyl cation	c2h+
271	ZnCH2	Zinc methylene	znch2
272	C2H2	Acetylene	c2h2
273	CCH2	vinylidene	vinylidene
274	H2CC-	vinylidene anion	h2cc-
275	HCCH-	acetylene anion	c2h2-
276	Si2H2	disilyne	si2h2
277	CH3Li	methyl lithium	ch3li
278	CuCH3	monomethyl copper	cuch3
279	ZnCH3	Zinc monomethyl	znch3
280	CH2BH	methyleneborane	ch2bh
281	C2H3	vinyl	c2h3
282	C2H3-	vinyl anion	c2h3-
283	C2H3+	vinyl cation	c2h3+
284	C2H4	Ethylene	c2h4
285	C2H4-	Ethylene anion	c2h4-
286	C2H4+	Ethylene cation	c2h4+
287	CH3CH	methylmethylene	ch3ch
288	CH2SiH2	silaethylene	ch2sih2
289	Si2H4	Disilene	si2h4
290	CH3BH2	methylborane	ch3bh2
291	C2H5	Ethyl radical	c2h5
292	C2H5-	Ethyl anion	c2h5-
293	C2H5+	Ethyl cation	c2h5+
294	C2H6	Ethane	c2h6
295	C2H6+	ethane cation	c2h6+
296	CH3SiH3	methyl silane	ch3sih3
297	GeH3CH3	methyl germane	geh3ch3
298	C2H7+	Ethane, protonated	c2h7+
299	LiN	Lithium Nitride	lin
300	LiN+	Lithium Nitride cation	lin+
301	LiP	Lithium monophosphide	lip
302	BeN	Beryllium mononitride	ben
303	BeN+	Beryllium mononitride cation	ben+
304	MgN	Magnesium Nitride	mgn
305	AlN-	aluminum mononitride anion	aln-
306	AlN+	aluminum mononitride cation	aln+
307	BP	Boron monophosphide	bp
308	AlP	Aluminum monophosphide	alp
309	GaN	Gallium mononitride	gan
310	GaP	Gallium monophosphide	gap
311	GaAs	Gallium arsenide	gaas
312	CN	Cyano radical	cn
313	CP	Carbon monophosphide	cp
314	CP-	carbon monophosphide anion	cp-
315	CP+	carbon monophosphide cation	cp+
316	SiN	Silicon nitride	sin
317	SiN-	silicon mononitride anion	sin-
318	SiN+	silicon mononitride cation	sin+
319	SiP-	Silicon monophosphide anion	sip-
320	SiP+	Silicon monophosphide cation	sip+
321	TiN	Titanium mononitride	tin
322	N2	Nitrogen diatomic	n2
323	N2+	diatomic nitrogen cation	n2+
324	PN	Phosphorus mononitride	pn
325	PN-	phosphorus nitride anion	pn-
326	PN+	phosphorus nitride cation	pn+
327	P2-	phosphorus diatomic anion	p2-
328	P2+	phosphorus diatomic cation	p2+
329	AsN	Arsenic mononitride	asn
330	AsP	Arsenic monophosphide	asp
331	SbN	Antimony nitride	sbn
332	As2	Arsenic diatomic	as2
333	HNB	hydrogen nitrogen boron	hnb
334	HNC	hydrogen isocyanide	hnc
335	HCN-	Hydrogen cyanide anion	hcn-
336	HNC+	hydrogen isocyanide cation	hnc+
337	HCP	Phosphaethyne	hcp
338	HCP+	Phosphaethyne cation	hcp+
339	NNH	Dinitrogen monohydride	nnh
340	NNH+	Dinitrogen monohydride cation	nnh+
341	HPO	Hydrogen phosphorus oxide	hpo
342	HPO+	Hydrogen phosphorus oxide cation	hpo+
343	LiNH2	lithium amide	linh2
344	HBNH	Boranimine	hbnh
345	CNH2	Aminomethylidyne radical	cnh2
346	CNH2+	N-protonated hydrogen isocyanide	cnh2+
347	H2CN	Dihydrogen cyanide radical	h2cn
348	H2CN+	hydrocyanonium cation	h2cn+
349	HCNH	methyleneazane	hcnh
350	HCNH+	N-protonated HCN	hcnh+
351	H2NN	Isodiazene	h2nn
352	N2H2	(Z)-Diazene	n2h2z
353	N2H2+	trans-diazene cation	n2h2+
354	CH2NH	Methanimine	ch3n
355	CH2NH+	Methanimine cation	ch2nh+
356	CHNH2	aminomethylene	chnh2
357	CHNH2+	Aminocarbene cation	chnh2+
358	BH2NH2	Boranamine	bh2nh2
359	N2H4	Hydrazine	n2h4
360	N2H4+	hydrazine cation	n2h4+
361	P2H4	Diphosphine	p2h4
362	CH3NH2	methyl amine	ch3nh2
363	CH3NH2+	methyl amine cation	ch3nh2+
364	CH3PH2	Methyl phosphine	ch3ph2
365	SiH3NH2	Silane, amino	sih3nh2
366	N2H5+	protonated hydrazine	n2h5+
367	BH3NH3	borane ammonia	bh3nh3
368	CH3NH3	methyl ammonium radical	ch3nh3
369	CH3NH3+	protonated methylamine	ch3nh3+
370	CH3PH3+	methyl phosphine, protonated	ch3ph3+
371	NH3NH3	Ammonia Dimer	nh3nh3
372	N2H7+	ammonia ammonium dimer	n2h7+
373	LiO	lithium oxide	lio
374	LiO-	lithium oxide anion	lio-
375	LiS+	Lithium sulfide cation	lis+
376	NaO	sodium monoxide	nao
377	NaO-	sodium oxide anion	nao-
378	KO	Potassium monoxide	ko
379	KO+	Potassium monoxide cation	ko+
380	NaS	Sodium sulfide	nas
381	CuO	Copper Monoxide	cuo
382	LiSe	Lithium monoselenide	lise
383	BeO	beryllium oxide	beo
384	BeS	beryllium sulfide	bes
385	MgO	magnesium oxide	mgo
386	CaO	Calcium monoxide	cao
387	MgS	magnesium sulfide	mgs
388	MgS-	magnesium sulfide anion	mgs-
389	MgS+	magnesium sulfide cation	mgs+
390	ZnO	zinc monoxide	zno
391	ZnS	Zinc sulfide	zns
392	BeS-	Beryllium monosulfide anion	bes-
393	BeS+	Beryllium monosulfide cation	bes+
394	BO	boron monoxide	bo
395	AlO	Aluminum monoxide	alo
396	AlO-	Aluminum monoxide anion	alo-
397	AlO+	aluminum monoxide cation	alo+
398	BS	boron sulfide	bs
399	BS-	boron monosulfide anion	bs-
400	BS+	boron monosulfide cation	bs+
401	AlS	Aluminum sulfide	als
402	AlS-	aluminum monosulfide anion	als-
403	AlS+	aluminum monosulfide cation	als+
404	ScO	Scandium monoxide	sco
405	GaO	Gallium monoxide	gao
406	GaS	Gallium monosulfide	gas
407	CO	Carbon monoxide	co
408	CS	carbon monosulfide	cs
409	CS-	carbon monosulfide anion	cs-
410	CS+	carbon monosulfide cation	cs+
411	SiO	Silicon monoxide	sio
412	SiO-	silicon monoxide anion	sio-
413	SiO+	silicon monoxide cation	sio+
414	SiS	silicon monosulfide	sis
415	SiS-	silicon monosulfide anion	sis-
416	SiS+	silicon monosulfide cation	sis+
417	TiO	Titanium monoxide	tio
418	CSe	Carbon monoselenide	cse
419	CSe-	Carbon monoselenide anion	cse-
420	CSe+	Carbon monoselenide cation	cse+
421	GeO+	Germanium monoxide cation	geo+
422	GeS	Germanium monosulfide	ges
423	SiSe+	Silicon Monoselenide cation	sise+
424	GeSe	Germanium monoselenide	gese
425	NO	Nitric oxide	no
426	NO+	nitric oxide cation	no+
427	NS	Mononitrogen monosulfide	ns
428	NS-	nitrogen sulfide anion	ns-
429	NS+	nitrogen sulfide cation	ns+
430	PO-	phosphorus monoxide anion	po-
431	PO+	phosphorus monoxide cation	po+
432	PS-	phosphorus monosulfide anion	ps-
433	PS+	phosphorus monosulfide cation	ps+
434	VO	Vanadium monoxide	vo
435	AsO	Arsenic monoxide	aso
436	NSe	Nitrogen monoselenide	nse
437	AsS	Arsenic monosulfide	ass
438	PSe	Phosphorus monoselenide	pse
439	AsSe	Arsenic monoselenide	asse
440	O2	Oxygen diatomic	o2
441	O2--	dioxygen dianion	o2--
442	O2+	diatomic oxygen cation	o2+
443	SO-	sulfur monoxide anion	so-
444	SO+	sulfur monoxide cation	so+
445	S2-	sulfur diatomic anion	s2-
446	SeO	Selenium monoxide	seo
447	SeO-	selenium monoxide anion	seo-
448	SeO+	selenium monoxide cation	seo+
449	SeS	Selenium monosulfide	ses
450	SeS-	selenium monosulfide anion	ses-
451	SeS+	selenium monosulfide cation	ses+
452	TeO	Tellurium monoxide	teo
453	Se2-	selenium diatomic anion	se2-
454	Se2+	selenium diatomic cation	se2+
455	Te2	Tellurium diatomic	te2
456	LiOH	lithium hydroxide	lioh
457	NaOH	sodium hydroxide	naoh
458	KOH	Potassium hydroxide	koh
459	BeOH	beryllium monohydroxide	beoh
460	MgOH	magnesium hydroxide	mgoh
461	CaOH	Calcium monohydroxide	caoh
462	HBO	Boron hydride oxide	hbo
463	HBS	hydrogen boron sulfide	hbs
464	COH	Hydroxymethylidyne	coh
465	COH+	Carbon Monoxide, protonated	coh+
466	HCO	Formyl radical	hco
467	HCO-	formyl anion	hco-
468	HCO+	Formyl cation	hco+
469	HCS	Thioformyl radical	hcs
470	HCS-	Thioformyl anion	hcs-
471	HCS+	Thioformyl cation	hcs+
472	HNO	Nitrosyl hydride	hno
473	HNO-	Nitrosyl hydride anion	hno-
474	HNO+	Nitrosyl hydride cation	hno+
475	NOH	Hydroxyimidogen	noh
476	NOH+	O-protonated nitric oxide	noh+
477	HNS	Sulfur imide	hns
478	HNS-	Sulfur imide anion	hns-
479	HO2-	Hydroperoxy anion	ho2-
480	HO2+	Hydroperoxy cation	ho2+
481	HS2	Thiosulfeno radical	hs2
482	H2CO	Formaldehyde	h2co
483	H2CO-	formaldehyde anion	h2co-
484	HOCH	hydroxycarbene	hoch
485	H2CS-	thioformaldehyde anion	h2cs-
486	H2CS+	thioformaldehyde cation	h2cs+
487	H2NO	nitroxide	h2no
488	H2O2	Hydrogen peroxide	h2o2
489	H2O2+	Hydrogen peroxide cation	h2o2+
490	H2OO	water oxide	h2oo
491	HOSH	hydrogen thioperoxide	hosh
492	H2Se2	hydrogen diselenide	h2se2
493	CH2OH	Hydroxymethyl radical	ch2oh
494	CH3O	Methoxy radical	ch3o
495	CH3O-	methoxy anion	ch3o-
496	CH3O+	Methoxy cation	ch3o+
497	CH3S	thiomethoxy	ch3s
498	NH2OH	hydroxylamine	nh2oh
499	NH2OH+	Hydroxylamine cation	nh2oh+
500	NH3O	Ammonia Oxide	nh3o
501	NH2SH	Thiohydroxylamine	nh2sh
502	NH3S	sulfidoazane	nh3s
503	H3O2+	hydrogen peroxide, protonated	h3o2+
504	CH3OH	Methyl alcohol	ch3oh
505	CH3OH-	Methyl alcohol anion	ch3oh-
506	CH3OH+	Methyl alcohol cation	ch3oh+
507	CH3SH+	Methanethiol cation	ch3sh+
508	SiH3OH	silanol	sih3oh
509	CH3SeH	Methane selenol	ch3seh
510	NH2OH2+	protonated hydroxylamine	nh2oh2+
511	NH3OH+	N-protonated hydroxylamine	nh3oh+
512	H2OH2O	water dimer	h2oh2o
513	CH3OH2+	Methanol, protonated	ch3oh2+
514	H2ONH3	Water Ammonia Dimer	h2onh3
515	H5O2+	Dihydroxonium ion	h5o2+
516	LiF	lithium fluoride	lif
517	LiCl-	lithium chloride anion	licl-
518	LiCl+	lithium chloride cation	licl+
519	NaF	sodium fluoride	naf
520	KF	Potassium Fluoride	kf
521	NaCl	Sodium Chloride	nacl
522	NaCl-	sodium chloride anion	nacl-
523	NaCl+	sodium chloride cation	nacl+
524	KCl	Potassium Chloride	kcl
525	CuF	Copper monofluoride	cuf
526	LiBr	Lithium Bromide	libr
527	LiBr-	lithium bromide anion	libr-
528	LiBr+	lithium bromide cation	libr+
529	CuCl	Copper monochloride	cucl
530	NaBr	Sodium Bromide	nabr
531	NaBr-	sodium bromide anion	nabr-
532	NaBr+	sodium bromide cation	nabr+
533	KBr	Potassium Bromide	kbr
534	LiI	Lithium Iodide	lii
535	NaI	Sodium Iodide	nai
536	KI	Potassium Iodide	ki
537	BeF	Beryllium monofluoride	bef
538	BeCl	beryllium monochloride	becl
539	MgF	Magnesium monofluoride	mgf
540	CaF	Calcium monofluoride	caf
541	MgCl	magnesium monochloride	mgcl
542	MgCl-	magnesium monochloride anion	mgcl-
543	MgCl+	magnesium monochloride cation	mgcl+
544	CaCl	calcium monochloride	cacl
545	TiCl	Titanium Monochloride	ticl
546	ZnF	Zinc monofluoride	znf
547	ZnF-	Zinc monofluoride anion	znf-
548	ZnF+	Zinc monofluoride cation	znf+
549	ZnCl	Zinc monochloride	zncl
550	CaBr	Calcium monobromide	cabr
551	BeCl-	beryllium monochloride anion	becl-
552	BeCl+	beryllium monochloride cation	becl+
553	BF	Boron monofluoride	bf
554	AlF	Aluminum monofluoride	alf
555	AlF-	Aluminum monofluoride anion	alf-
556	AlF+	Aluminum monofluoride cation	alf+
557	BCl	boron monochloride	bcl
558	BCl-	boron monochloride anion	bcl-
559	BCl+	boron monochloride cation	bcl+
560	AlCl-	aluminum monochloride anion	alcl-
561	AlCl+	aluminum monochloride cation	alcl+
562	ScF	Scandium monofluoride	scf
563	BBr	Boron monobromide	bbr
564	GaF	Gallium monofluoride	gaf
565	GaF+	Gallium monofluoride cation	gaf+
566	AlBr	Aluminum monobromide	albr
567	GaCl	Gallium monochloride	gacl
568	GaCl+	Gallium monochloride cation	gacl+
569	AlI	Aluminum monoiodide	ali
570	GaBr	Gallium monobromide	gabr
571	CF	Fluoromethylidyne	cf
572	CCl	carbon monochloride	ccl
573	CCl-	carbon monochloride anion	ccl-
574	CCl+	carbon monochloride cation	ccl+
575	SiF-	silicon monofluoride anion	sif-
576	SiCl	Clorosilylidyne	sicl
577	SiCl-	silicon monochloride anion	sicl-
578	SiCl+	silicon monochloride cation	sicl+
579	CBr	Carbon monobromide	cbr
580	GeF	Germanium monofluoride	gef
581	GeF+	Germanium monofluoride cation	gef+
582	GeCl	Germanium monochloride	gecl
583	GeCl+	Germanium monochloride cation	gecl+
584	SiBr	Silicon monobromide	sibr
585	SiBr+	Silicon monobromide cation	sibr+
586	NF	nitrogen fluoride	nf
587	NCl-	nitrogen monochloride anion	ncl-
588	NCl+	nitrogen monochloride cation	ncl+
589	PF	phosphorus monofluoride	pf
590	PF-	phosphorus monofluoride anion	pf-
591	PF+	phosphorus monofluoride cation	pf+
592	PCl	phosphorus chloride	pcl
593	PCl-	phosphorus monochloride anion	pcl-
594	PCl+	phosphorus monochloride cation	pcl+
595	AsF	Arsenic monofluoride	asf
596	NBr	nitrogen monobromide	nbr
597	AsCl	Arsenic monochloride	ascl
598	PBr	Phosphorus monobromide	pbr
599	SbF	Antimony monofluoride	sbf
600	SbCl	Antimony monochloride	sbcl
601	FO	Oxygen monofluoride	fo
602	ClO-	chlorine monoxide anion	clo-
603	ClO+	chlorine monoxide cation	clo+
604	SF-	sulfur monofluoride anion	sf-
605	SCl-	sulfur monochloride anion	scl-
606	BrO	Bromine monoxide	bro
607	BrO-	Bromine monoxide anion	bro-
608	BrO+	Bromine monoxide cation	bro+
609	SeF	Selenium monofluoride	sef
610	SBr+	Sulfur monobromide cation	sbr+
611	SeCl	Selenium monochloride	secl
612	IO	Iodine monoxide	io
613	SeBr	Selenium monobromide	sebr
614	BrCl	Bromine monochloride	brcl
615	F2	Fluorine diatomic	f2
616	ClF-	clorine monofluoride anion	clf-
617	ClF+	clorine monofluoride cation	clf+
618	Cl2	Chlorine diatomic	cl2
619	BrF	Bromine monofluoride	brf
620	BrF-	bromine fluoride anion	brf-
621	BrF+	bromine fluoride cation	brf+
622	BrCl-	bromine chloride anion	brcl-
623	BrCl+	bromine chloride cation	brcl+
624	IF	Iodine monofluoride	if
625	Br2	Bromine diatomic	br2
626	Br2-	bromine diatomic anion	br2-
627	Br2+	bromine diatomic cation	br2+
628	ICl	Iodine monochloride	icl
629	IBr	Iodine monobromide	ibr
630	I2	Iodine diatomic	i2
631	I2+	Iodine diatomic cation	i2+
632	HCF	Fluoromethylene	hcf
633	HCCl	Chloromethylene	hccl
634	HSiF	fluorosilylene	hsif
635	HSiCl	Chlorosilylene	hsicl
636	HSiBr	monobromosilylene	hsibr
637	CHBr	bromomethylene	chbr
638	HOF	Hypofluorous acid	hfo
639	DOCl	Hypochlorous acid-d	docl
640	HOCl+	hypochlorous acid cation	hocl+
641	HOBr	Hypobromous acid	hobr
642	HOBr+	Hypobromous acid cation	hobr+
643	HOI	Hypoiodous acid	hoi
644	F2H+	Fluorine, protonated	f2h+
645	FHF	Hydrogen difluoride	fhf
646	FHF-	Hydrogen difluoride anion	fhf-
647	ClFH+	Chlorine fluoride, F-protonated	clfh+
648	FClH+	Chlorine fluoride, Cl-protonated	fclh+
649	Cl2H+	Chlorine, protonated	cl2h+
650	CH2Br	bromomethyl radical	ch2br
651	CH2F	fluoromethyl radical	ch2f
652	CH2F+	fluoromethyl cation	ch2f+
653	CH2Cl+	chloromethyl cation	ch2cl+
654	CH2Cl	chloromethyl radical	ch2cl
655	NH2F	monofluoroamine	nh2f
656	NH2Cl	chloramine	nh2cl
657	H2F2	Hydrogen fluoride dimer	h2f2
658	CH3F+	methyl fluoride cation	ch3f+
659	CD3F	methylfluoride-d3	cd3f
660	CH3F	Methyl fluoride	ch3f
661	CD3Cl	methyl chloride d3	cd3cl
662	CH3Cl+	Methyl chloride cation	ch3cl+
663	SiH3F	monofluorosilane	sih3f
664	CH3Br	methyl bromide	ch3br
665	GeH3F	monofluorogermane	geh3f
666	GeH3Cl	monochlorogermane	geh3cl
667	SiH3Br	bromosilane	sih3br
668	CH3I	methyl iodide	ch3i
669	SiH3I	Silyl Iodide	sih3i
670	NH3Cl+	protonated monochloroammonia	nh3cl+
671	CH3ClH+	methyl chloride, protonated	ch3clh+
672	NH4Cl	Ammonium chloride	nh4cl
673	LiNe+	Lithium Neon cation	line+
674	Ne2	Neon diatomic	ne2
675	Ne2+	Neon diatomic cation	ne2+
676	Ar2	Argon diatomic	ar2
677	Ar2+	Argon diatomic cation	ar2+
678	Li3	Lithium trimer	li3
679	Li3+	Lithium trimer cation	li3+
680	C3	carbon trimer	c3
681	C3+	carbon trimer cation	c3+
682	SiC2	Silicon dicarbide	sic2
683	C3H3	cyclopropenyl radical	cpr
684	C3H3	Propargyl radical	propargyl
685	C3H3-	Propargyl anion	c3h3-
686	C3H3+	cyclopropenyl cation	cpr+
687	C3H3+	Propargyl cation	c3h3+
688	C3H4	cyclopropene	cprop
689	CH2CCH2	allene	allene
690	CH3CCH	propyne	propyne
691	C3H5	Allyl radical	allyl
692	C3H5+	Allyl cation	allyl+
693	CH3CHCH	1-propenyl radical	ch3chch
694	Zn(CH3)2	dimethyl zinc	dmz
695	C3H6	Cyclopropane	c3h6
696	CH2CHCH3	Propene	propene
697	C3H7	n-Propyl radical	npropyl
698	C3H7+	cyclopropane, protonated	c3h7+
699	CH3CHCH3	Isopropyl radical	isopropyl
700	CH3CHCH3+	Isopropyl cation	prop2yl+
701	C3H8	Propane	propane
702	SiH2(CH3)2	dimethylsilane	dms
703	LiCN	lithium cyanide	licn
704	NaCN	Sodium Cyanide	nacn
705	KCN	Potassium cyanide	kcn
706	CuCN	Copper cyanide	cucn
707	ZnCN	Zinc monocyanide	zncn
708	ZnNC	Zinc isocyanide	znnc
709	AlCN	Aluminum monocyanide	alcn
710	AlNC	Aluminum isocyanide	alnc
711	CN2	3H-Diazirin-3-ylidene	cn2
712	CNN	Diazocarbene	cnn
713	NCN	Cyanoimidogen	ncn
714	N3	azide radical	n3
715	N3-	azide anion	n3-
716	N3+	azide cation	n3+
717	HCCN	cyanomethylene	hccn
718	HCNN	diazomethyl radical	hcnn
719	HN3	hydrogen azide	hn3
720	HN3+	Hydrazoic acid cation	hn3+
721	HNCNH	diiminomethane	hncnh
722	CH2N2	diazirine	ch2n2
723	CH2NN	diazomethane	ch2nn
724	NH2CN	cyanamide	cyanamide
725	HNNNH+	1,2-Triazadienium	n2h3+
726	NH2NN+	hydrazoic acid, protonated	nh2nn+
727	CH3CN	Acetonitrile	ch3cn
728	CH3CN-	acetonitrile anion	ch3cn-
729	CH3CN+	Acetonitrile cation	ch3cn+
730	CH3NC	methyl isocyanide	ch3nc
731	CHNCH2	2H-Azirine	c157164
732	CHNHCH	1H-Azirine	chnhch
733	H2CCNH	Ethenimine	ch2cnh
734	H2CNCH	methyleneaminomethylene	ch2nch
735	HCCNH2	Ethynamine	hccnh2
736	HCNCH2+	2H-Azirine cation	hcnch2+
737	HNCNH2+	diiminomethane, protonated	hncnh2+
738	NCNH3+	Cyanamide, protonated	ncnh3+
739	NH2CNH+	cyanamide, cn protonated	nh2cnh+
740	NH3CN+	cyanamide, amine protonated	nh3cn+
741	CH2CHNH	vinylazine	ch2chnh
742	CH3CHN	methylmethaniminyl radical	ch3chn
743	NHCHNH2	aminomethanimine	cn2h4
744	C2H5N	Aziridine	c2h5n
745	CH2CHNH2	aminoethene	aminoethene
746	CH2NCH3	N-methylmethanimine	nmm
747	CH3CHNH	ethanimine	ethanimine
748	NH2BHNH2	diaminoborane	nh2bhnh2
749	C2H5NH+	Protonated Aziridine	c2h5nh+
750	C2H6N+	aziridine, protonated	c2h6n+
751	NH2CH2NH2	diaminomethane	nh2ch2nh2
752	CH3CH2NH2	Ethylamine	etam
753	CH3NHCH3	Dimethylamine	ch3nhch3
754	CH3PHCH3	dimethylphosphine	ch3phch3
755	NH2CH2NH3+	diaminoethane, protonated	pdam
756	(CH3)2NH2+	dimethylammonium cation	dmam
757	CH3CH2NH3+	ethylamine, protonated	pea
758	Li2O+	dilithium oxide cation	li2o+
759	Na2O	disodium monoxide	na2o
760	Na2S	Sodium sulfide	na2s
761	LiO2	Lithium dioxide	lio2
762	NaO2	Sodium superoxide	nao2
763	CCO	Dicarbon monoxide	cco
764	CNO-	fulminate	cno-
765	NCO	isocyanato radical	nco
766	NCO-	cyanate	nco-
767	SCN	thiocyanato radical	scn
768	SCN-	thiocyanide anion	scn-
769	BO2	Boron dioxide	bo2
770	BO2-	Boron dioxide anion	bo2-
771	BO2+	Boron dioxide cation	bo2+
772	N2O	Nitrous oxide	n2o
773	N2O-	Nitrous oxide anion	n2o-
774	N2O+	Nitrous oxide cation	n2o+
775	PPO	Phosphorus oxide phosphide	ppo
776	CO2	Carbon dioxide	co2
777	CO2-	Carbon dioxide anion	co2-
778	CO2+	Carbon dioxide cation	co2+
779	OCS+	Carbonyl sulfide cation	cos+
780	SiO2	silicon dioxide	sio2
781	CS2	Carbon disulfide	cs2
782	CS2-	Carbon disulfide anion	cs2-
783	CS2+	Carbon disulfide cation	cs2+
784	TiO2	Titanium dioxide	tio2
785	GeO2	Germanium dioxide	geo2
786	OCSe	Carbonyl selenide	ocse
787	SCSe	Carbon sulfide selenide	scse
788	GeS2	Germanium disulfide	ges2
789	CSe2	Carbon diselenide	cse2
790	SCTe	Carbon sulfide Telluride	scte
791	NO2	Nitrogen dioxide	no2
792	NO2-	Nitrogen dioxide anion	no2-
793	NO2+	Nitrogen dioxide cation	no2+
794	PO2	Phosphorus dioxide	po2
795	PO2-	Phosphorus dioxide anion	po2-
796	PO2+	Phosphorus dioxide cation	po2+
797	AsO2	Aresenic dioxide	aso2
798	O3-	Ozone anion	o3-
799	O3+	Ozone cation	o3+
800	SO2-	Sulfur dioxide anion	so2-
801	SO2+	Sulfur dioxide cation	so2+
802	SSO	Disulfur monoxide	sso
803	S3-	Sulfur trimer anion	s3-
804	SeO2	Selenium dioxide	seo2
805	SeO2+	Selenium dioxide cation	seo2+
806	TeO2	Tellurium Dioxide	teo2
807	HCCO	ketenyl radical	ketenyl
808	CS2H+	Carbon disulfide, protonated	cs2h+
809	HCNO	fulminic acid	hcno
810	HNCO	Isocyanic acid	hnco
811	HOCN	cyanic acid	hocn
812	HNCS	Isothiocyanic acid	hncs
813	HSCN	thiocyanic acid	hscn
814	HCO2-	formate anion	hco2-
815	HNNO	nitrosoazane	hnno
816	HNNO+	Nitrous oxide, N-protonated	hnno+
817	NNOH+	Nitrous Oxide, O-protonated	nnoh+
818	HCOO	formate neutral radical	hcoo
819	HOCO+	Hydrocarboxyl cation	hoco+
820	HNO2	Nitrous acid	hno2
821	HNO2+	nitrous acid cation	hno2+
822	O3H+	protonated ozone	o3h+
823	SO2H+	protonated sulfur dioxide	so2h+
824	C2H2O	Oxirene	oxirene
825	CH2CO	Ketene	ch2co
826	CH2CO+	Ketene cation	ch2co+
827	Be(OH)2	Beryllium hydroxide	beo2h2
828	Mg(OH)2	Magnesium dihydroxide	h2mgo2
829	NH2NO	Nitrosamide	nh2no
830	CH2O2	Dioxirane	diox
831	H2COO	Dioxymethyl radical	h2coo
832	H2COO+	dioxymethyl cation	h2coo+
833	HCOOH	Formic acid	ch2o2
834	H2O3	Hydrogen trioxide	h2o3
835	NaOCH3	Sodium methoxide	naoch3
836	CH2BOH	hydroxy(methylene)borane	ch2boh
837	BH3CO	Borane carbonyl	bh3co
838	CH3BO	Borane, methyloxo-	ch3bo
839	CH2CHO	Vinyloxy radical	ch2cho
840	CH2COH+	ketene, protonated	ch2coh+
841	CH3CO	Acetyl radical	ch3co
842	CH3CO-	Acetyl anion	ch3co-
843	CH3CO+	acetyl cation	ch3co+
844	CH2NOH	formaldoxime	ch2noh
845	CH3NO	nitrosomethane	ch3no
846	CHONH2	formamide	formamide
847	CNOH3	1,2-oxaziridine	cnoh3
848	HOCHNH	hydroxymethylimine	hochnh
849	CHSNH2	thioformamide	chsnh2
850	NHCHSH	Methanimidothioic acid	nhchsh
851	CH2OOH	CH2OOH radical	ch2ooh
852	CH3OO	methylperoxy radical	ch3oo
853	CH3OO-	methylperoxy anion	ch3oo-
854	CH3OO+	methylperoxy cation	ch3oo+
855	C2H4O	Ethylene oxide	c2h4o
856	C2H4O+	ethylene oxide cation	c2h4o+
857	CH2CHOH	ethenol	ch2choh
858	CH3CHO	Acetaldehyde	ch3cho
859	CH3CHO+	acetaldehyde cation	ch3cho+
860	H2COCH2+	Methyl, (methyleneoxoniumyl)-	h2coch2+
861	CH2CHSH	Ethenethiol	ch2chsh
862	H2CONH2+	protonated formamide	h2conh2+
863	NH2CHOH+	Formamide, O-protonated	nh2choh+
864	NH3CHO+	Formamide, N-Protonated	nh3cho+
865	CH2(OH)2	methanediol	ch2o2h2
866	CH3OOH	Methyl peroxide	ch3ooh
867	HSCH2SH	Methanedithiol	ch4s2
868	H2OH2CO	water formaldehyde dimer	h2oh2co
869	C2H4OH+	ethylene oxide, protonated	c2h4oh+
870	CH2CH2OH	2-hydroxy ethyl radical	ch2ch2oh
871	CH3CH2O	Ethoxy radical	ethoxy
872	CH3CHOH	1-hydroxy-ethyl radical	ch3choh
873	CH3CHOH+	acetaldehyde, protonated	ch3choh+
874	CH3OCH2	methoxymethyl radical	ch3och2
875	NH2CH2OH	aminomethanol	nh2ch2oh
876	CH3CH2OH	Ethanol	etoh
877	CH3OCH3	Dimethyl ether	meome
878	CH3SCH3	Dimethyl sulfide	mesme
879	CH3SCH3+	dimethyl sulfide cation	mesme+
880	CH3SeCH3	dimethylselenide	dmse
881	CH3OHH2O	methanol water dimer	ch3ohh2o
882	H2OCH3OH	water methanol dimer	h2och3oh
883	CuF2	Copper difluoride	cuf2
884	ZnF2	Zinc difluoride	znf2
885	CNF	iso cyanogen fluoride	cnf
886	FCN	Cyanogen fluoride	fcn
887	ClCN	chlorocyanogen	clcn
888	BrCN	Cyanogen bromide	brcn
889	ICN	Cyanogen iodide	icn
890	FBO	Boron monofluoride monoxide	fbo
891	BeF2	Beryllium fluoride	bef2
892	MgF2	Magnesium fluoride	mgf2
893	BeCl2	Beryllium chloride	becl2
894	MgCl2	Magnesium dichloride	mgcl2
895	CaCl2	Calcium Chloride	cacl2
896	ZnCl2	Zinc dichloride	zncl2
897	BeBr2	Beryllium bromide	bebr2
898	CaBr2	Calcium dibromide	cabr2
899	CaF2	Calcium difluoride	caf2
900	FCO	Carbonyl fluoride	fco
901	FCO+	Carbonyl fluoride cation	fco+
902	ClCO	carbonyl monochloride	clco
903	BF2	Boron difluoride radical	bf2
904	FNO	Nitrosyl fluoride	fno
905	ClNO	Nitrosyl chloride	clno
906	BrNO	Nitrosyl bromide	brno
907	INO	Nitrosyl iodide	ino
908	CF2	Difluoromethylene	cf2
909	CF2-	Difluoromethylene anion	cf2-
910	CF2+	Difluoromethylene cation	cf2+
911	CFCl	chlorofluoromethylene	cfcl
912	SiF2	Silicon difluoride	sif2
913	SiF2+	Silicon difluoride cation	sif2+
914	CCl2	dichloromethylene	ccl2
915	CCl2-	dichloromethylene anion	ccl2-
916	CCl2+	dichloromethylene cation	ccl2+
917	SiCl2	Dichlorosilylene	sicl2
918	GeF2	Germanium difluoride	gef2
919	CBr2	dibromomethylene	cbr2
920	FOO	Dioxygen monofluoride radical	foo
921	FOO+	Fluorine dioxide cation	foo+
922	ClOO	chloroperoxy radical	cloo
923	ClOO+	chloroperoxy cation	cloo+
924	OClO-	Chlorine dioxide anion	oclo-
925	OClO+	Chlorine dioxide cation	oclo+
926	ClS2	Sulfur chloride	cls2
927	BrOO	Bromine dioxide	broo
928	OBrO	Bromine dioxide radical	obro
929	NF2	Difluoroamino radical	nf2
930	NF2+	Difluoroamino cation	nf2+
931	PF2	Phosphorus difluoride	pf2
932	PF2+	Phosphorus difluoride cation	pf2+
933	F2O	Difluorine monoxide	f2o
934	SF2-	sulfur difluoride anion	sf2-
935	SF2+	sulfur difluoride cation	sf2+
936	Cl2O	Dichlorine monoxide	cl2o
937	SeF2	Selenium difluoride	sef2
938	BrOCl	Bromine hypochlorite	brocl
939	BrOBr	Bromine oxide	brobr
940	F3-	trifluoride anion	f3-
941	Cl3-	trichloride anion	cl3-
942	Br3-	tribromide anion	br3-
943	I3-	triiodide	i3-
944	SFCl	Sulfur chloride fluoride	sfcl
945	HCCF	Fluoroacetylene	hccf
946	HCCF+	fluoroacetylene cation	hccf+
947	HCCCl	Chloroacetylene	hcccl
948	HCCBr	bromoacetylene	hccbr
949	HFCO	formyl fluoride	hfco
950	HFCO+	formyl fluoride cation	hfco+
951	COHCl	Formyl chloride	cohcl
952	COHBr	Formyl bromide	cohbr
953	BHF2	Difluoroborane	bhf2
954	BHCl2	Borane, dichloro-	bhcl2
955	CHCl2	dichloromethyl radical	chcl2
956	CHF2	difluoromethyl radical	chf2
957	CHF2+	difluoromethyl cation	chf2+
958	CHFCl	Chlorofluoromethyl radical	chfcl
959	CHFCl+	Chlorofluoromethyl cation	chfcl+
960	CHCl2+	dichloromethyl cation	chcl2+
961	CHBr2	dibromomethyl radical	chbr2
962	HOClO	Chlorous acid	hoclo
963	NHF2	difluoramine	nhf2
964	NHCl2	dichloroamine	nhcl2
965	CH2FCl	fluorochloromethane	ch2fcl
966	SiH2F2	difluorosilane	sih2f2
967	CH2Cl2	Methylene chloride	ch2cl2
968	CH2BrF	Methane, bromofluoro-	ch2fbr
969	CH2BrCl	Methane, bromochloro-	ch2clbr
970	CH2FI	fluoroiodomethane	ch2fi
971	CH2Br2	dibromomethane	ch2br2
972	CH2ClI	chloroiodomethane	ch2cli
973	CH2BrI	bromoiodomethane	ch2bri
974	CH2I2	Diiodomethane	ch2i2
975	SiH2Cl2	dichlorosilane	sih2cl2
976	CH3MgBr	Methyl Magnesium Bromide	ch3mgbr
977	CH2CHF	Ethene, fluoro-	ch2chf
978	CH2CHF+	fluoroethene cation	ch2chf+
979	C2H3Cl	Ethene, chloro-	ch2chcl
980	C2H3Br	vinyl bromide	c2h3br
981	C2H3I	Vinyl iodide	c2h3i
982	CH2FOH	fluoromethanol	ch2foh
983	CH3OCl	methyl hypochlorite	ch3ocl
984	CH2CH2Cl	2-chloroethyl radical	ch2ch2cl
985	CHClCH3	1-chloroethyl radical	chclch3
986	C2H5F	fluoroethane	c2h5f
987	CH3CH2Cl	Ethyl chloride	c2h5cl
988	CH3SiFH2	fluoromethylsilane	ch3sifh2
989	C2H5Br	Ethyl bromide	etbr
990	C2H5I	Ethyl iodide	c2h5i
991	KrF2	Krypton difluoride	krf2
992	XeF2	Xenon difluoride	xef2
993	B4H10	Tetraborane(10)	b4h10
994	C4	Carbon tetramer	c4
995	C4+	Carbon tetramer cation	c4+
996	C4H2	Diacetylene	c4h2
997	C4H2+	diacetlyene cation	c4h2+
998	C2H3CCH	1-Buten-3-yne	c2h3cch
999	C4H4	cyclobutadiene	cbd
1000	C4H4	Tetrahedrane	c4h4
1001	H2CCCCH2	Butatriene	h2cccch2
1002	C4H6	1-Methylcyclopropene	c3100047
1003	C4H6	Cyclobutene	c822355
1004	C4H6	Methylenecyclopropane	c6142730
1005	CH2CCHCH3	1,2-Butadiene	butad12
1006	CH2CHCHCH2	1,3-Butadiene	c106990
1007	CH3CCCH3	2-Butyne	c503173
1008	CHCCH2CH3	1-Butyne	c107006
1009	CH3CHCHCH2	methylallyl radical	c4h7
1010	C4H8	methylcyclopropane	mcp
1011	CH2C(CH3)CH3	1-Propene, 2-methyl-	isobute
1012	CH2CHCH2CH3	1-Butene	bute1
1013	CH3CHCHCH3	2-Butene, (E)-	bute2e
1014	CH3CHCHCH3	2-Butene, (Z)-	bute2z
1015	B(CH3)3	trimethylborane	bme3
1016	Al(CH3)3	trimethyl aluminum	tma
1017	C(CH3)3	Tert-butyl radical	tbutyl
1018	CH2CH(CH3)2	Isobutyl radical	isobutyl
1019	CH3CHCH2CH3	2-Butyl radical	butyl2
1020	CH3CH(CH3)CH3	Isobutane	isobutane
1021	CH3CH2CH2CH3	Butane	butane
1022	SiH(CH3)3	trimethylsilane	trimsi
1023	Li3N	trilithium nitride	li3n
1024	C2N2	Cyanogen	c2n2
1025	C2N2+	Cyanogen cation	c2n2+
1026	P4	Phosphorus tetramer	p4
1027	As4	Arsenic tetramer	as4
1028	HCCCN	Cyanoacetylene	hcccn
1029	HCCCN+	Cyanoacetylene cation	hcccn+
1030	H2CNCN	cyanamide, methylene	ch2ncn
1031	HNCCNH	Ethenediimine	hnccnh
1032	C3H3N	acrylonitrile	ch2chcn
1033	C3H3N+	acrylonitrile cation	ch2chcn+
1034	CH3N3	methyl azide	ch3n3
1035	NH2CCNH2	Diaminoacetylene	daa
1036	NH2CH2CN	Aminoacetonitrile	aan
1037	CH3NHN2+	methyl azide, protonated	ch3nhn2+
1038	C2H5CN	ethyl cyanide	c2h5cn
1039	CH5N3	Guanidine	guanidine
1040	C4H6	Bicyclo[1.1.0]butane	c157335
1041	CH3NNCH3	(Z)-1,2-Dimethyldiazene	dmdiazz
1042	H2NCHCHNH2	diaminoethylene	dae
1043	CH6N3+	guanidinium	ch6n3+
1044	C3H7N	Cyclopropylamine	cpram
1045	CH7N3	triaminomethane	tam
1046	C3H7N	Azetidine	azet
1047	C4H8	cyclobutane	cbutane
1048	C2H8N2	Ethylenediamine	ethdiam
1049	CH3NHNHCH3	dimethyl hydrazine	dmh
1050	CH3CH(NH2)CH3	2-Propanamine	pram2
1051	N(CH3)3	Trimethylamine	trimeam
1052	NH2CH2CH2CH3	1-Propanamine	pram1
1053	P(CH3)3	trimethylphosphine	tmp
1054	N(SiH3)3	trisilylamine	tsa
1055	As(CH3)3	trimethyl arsine	tmas
1056	(CH3)3NH+	protonated trimethyl amine	ptma
1057	C3H7NH3+	n-propylamine, protonated	c3h7nh2
1058	Li2O2	dilithium dioxide	li2o2
1059	Na2O2	disodium dioxide	na2o2
1060	K2O2	dipotassium dioxide	k2o2
1061	C3O	Tricarbon monoxide	c3o
1062	B2O2	Diboron dioxide	b2o2
1063	ONNO	NO dimer	onno
1064	CO3	Carbon trioxide	co3
1065	CO3--	carbonate	co3--
1066	NO3	Nitrogen trioxide	no3
1067	NO3-	nitrate anion	no3-
1068	NO3+	nitrogen trioxide cation	no3+
1069	SO3-	Sulfur trioxide anion	so3-
1070	SO3--	Sulfate dianion	so3--
1071	SO3+	Sulfur trioxide cation	so3+
1072	SeO3	selenium trioxide	seo3
1073	TeO3	Tellurium trioxide	teo3
1074	HCO3-	bicarbonate anion	hco3-
1075	HNO3	Nitric acid	hno3
1076	HSO3	Hydroxysulfonyl radical	hso3
1077	NH2NO2	nitramide	nh2no2
1078	C2H2CO	cyclopropenone	c2h2co
1079	C3H2O	Propadienal	c3h2o
1080	HCCCHO	2-propynal	hcccho
1081	C2H2O2	Ethanedial	c2h2o2
1082	C2H2O2+	Ethanedial cation	c2h2o2+
1083	H2CO3	Carbonic acid	h2co3
1084	H2CS3	thiocarbonic acid	h2cs3
1085	H2NO3+	Nitric Acid, Protonated	h2no3+
1086	H2SO3	Sulfurous acid	h2so3
1087	C2H3NO	Nitrosoethylene	c2h3no
1088	CH3NCO	methylisocyante	ch3nco
1089	HOCH2CN	cyanomethanol	hoch2cn
1090	CH3COO-	acetate anion	ch3coo-
1091	CH3NO2	Methane, nitro-	ch3no2
1092	CH3ONO	Methyl nitrite	ch3ono
1093	NH2COOH	Carbamic acid	nh2cooh
1094	H3BO3	Boric acid	h3bo3
1095	H3CO3+	carbonic acid, protonated	h3co3+
1096	C3H4O	2-Propyn-1-ol	c107197
1097	C3H4O	allenol	c9000071
1098	C3H4O	Cyclopropanone	cpone
1099	C3H4O	Methylketene	c6004440
1100	CH2CHCHO	Acrolein	c3h4o
1101	NH2CONH2	Urea	urea
1102	NH2CONH2+	Urea cation	urea+
1103	NH2CSNH2	Thiourea	thiourea
1104	C2H4O2	1,3-dioxetane	c2h4o2
1105	CH3COOH	Acetic acid	ch3cooh
1106	CH3OCHO	methyl formate	ch3ocho
1107	CHOCH2OH	hydroxy acetaldehyde	haa
1108	NH2COOH2+	Carbamic acid, O-protonated	nh2cooh2+
1109	NH3COOH+	protonated Carbamic acid	nh3cooh+
1110	H2OHCOOH	Water formic acid dimer 1	h2ohcooh_10
1111	H2OHCOOH	Water formic acid dimer 2	h2ohcooh_11
1112	HCOOHH2O	Formic acid water dimer	hcoohh2o
1113	HOCH2OOH	hydroxy methyl peroxide	hoch2ooh
1114	CH3COCH2	Acetonyl radical	ch3coch2
1115	CH2C(OH)NH2	1-amino vinyl alchohol	ava
1116	CH3C(OH)=NH	Ethaninidic acid	eia
1117	CH3CHNOH	Acetaldoxime	acetaldoxime
1118	CH3CONH2	Acetamide	acetamide
1119	HCONHCH3	N-methylformamide	nmfa
1120	CH5N2O+	urea, N-protonated	ch4n2o+
1121	H2NCOHNH2+	urea, protonated	ureah+
1122	C2H5OO	ethylperoxy radical	c2h5oo
1123	CH3NNCH3	(E)-1,2-Dimethyldiazene	dmdiaze
1124	C3H5OH	Cyclopropanol	cproh
1125	C3H6O	2-Propen-1-ol	c107186
1126	C3H6O	Acetone enol	enol
1127	C3H6O	Oxetane	oxetane
1128	C3H6O	Propylene oxide	prox
1129	CH3CH2CHO	Propanal	propanal
1130	CH3COCH3	Acetone	acetone
1131	CH3COCH3-	acetone anion	ch3coch3-
1132	C3H6S	Thietane	thietane
1133	C3H6S	Thiirane, methyl-	methiirane
1134	CH3CSCH3	Thioacetone	ch3csch3
1135	C2H6O2	1,2-Ethanediol	ethdiol
1136	CH3OOCH3	dimethylperoxide	dmp
1137	CH3SOCH3	Dimethyl sulfoxide	dmso
1138	CH2SHCH2SH	1,2-Ethanedithiol	ethdisl
1139	CH3SSCH3	Disulfide, dimethyl	ch3ssch3
1140	CH3COHCH3+	acetone, protonated	acetoneh+
1141	HOCH2CH2NH2	monoethanolamine	mea
1142	C3H7OH	1-Propanol	proh
1143	CH3CHOHCH3	Isopropyl alcohol	isoproh
1144	CH3OC2H5	Ethane, methoxy-	etome
1145	C3H7SH	1-Propanethiol	prsh
1146	CH3CHSHCH3	2-Propanethiol	isoprsh
1147	CH3SCH2CH3	Ethane, (methylthio)-	etsme
1148	H2OCH3OCH3	water dimethylether dimer	h2och3och3
1149	Li2F2	Lithium fluoride dimer	li2f2
1150	Na2F2	Sodium Fluoride Dimer	na2f2
1151	Na2Cl2	Disodium dichloride	na2cl2
1152	C2Cl2	dichloroacetylene	c2cl2
1153	C2Cl2+	dichloroacetylene cation	c2cl2+
1154	FNO2	Nitryl fluoride	fno2
1155	FONO	Nitrosyl hypofluorite	fono
1156	ClNO2	Nitryl chloride	clno2
1157	ClONO	chlorine nitrite	clono
1158	BrONO	Bromine nitrite	brono
1159	N2F2	(Z)-Difluorodiazene	n2f2_z
1160	N2F2	Dinitrogen difluoride, (E)-	n2f2_e
1161	CF2O	Carbonic difluoride	f2co
1162	CF2O+	Carbonic difluoride cation	f2co+
1163	COFCl	Carbonic chloride fluoride	cofcl
1164	CCl2O	Phosgene	cl2co
1165	COBr2	Carbonic dibromide	cobr2
1166	BF3	Borane, trifluoro-	bf3
1167	BF3-	Borane, trifluoro- anion	bf3-
1168	BF3+	boron trifluoride cation	bf3+
1169	BClF2	Chlorodifluoroborane	bclf2
1170	AlF2Cl	Aluminum chloride difluoride	alclf2
1171	ScF3	Scandium trifluoride	ScF3
1172	AlFCl2	Aluminum dichloride fluoride	alcl2f
1173	BCl3	Borane, trichloro-	bcl3
1174	BCl3+	Boron Trichloride cation	bcl3+
1175	GaF3	Gallium trifluoride	gaf3
1176	AlCl3	Aluminum trichloride	alcl3
1177	GaCl3	Gallium trichloride	gacl3
1178	BBr3	Boron tribromide	bbr3
1179	AlBr3	Aluminum Bromide	albr3
1180	ClO3	Chlorine trioxide	clo3
1181	ClO3-	chlorate anion	clo3-
1182	BrO3-	Bromate anion	bro3-
1183	CF3	Trifluoromethyl radical	cf3
1184	CF3-	Trifluoromethyl anion	cf3-
1185	CF3+	Trifluoromethyl cation	cf3+
1186	CF2Cl	difluorochloromethyl radical	cf2cl
1187	SiF3	Silicon trifluoride radical	sif3
1188	SiF3+	Silicon trifluoride cation	sif3+
1189	CFCl2	dichlorofluoromethyl radical	cfcl2
1190	CCl3	Trichloromethyl radical	ccl3
1191	CCl3-	Trichloromethyl anion	ccl3-
1192	CCl3+	Trichloromethyl cation	ccl3+
1193	SiCl3	trichlorosilyl radical	sicl3
1194	SiCl3+	trichlorosilyl cation	sicl3+
1195	CBr3	tribromomethyl radical	cbr3
1196	FOOF	Perfluoroperoxide	foof
1197	ClOOCl	Dichlorine dioxide	cloocl
1198	FSSF	Difluorodisulfane	fssf
1199	S2F2	Thio-thionyl fluoride	s2f2
1200	SOCl2	thionyl chloride	socl2
1201	SeOCl2	selenium oxychloride	seocl2
1202	NF3	Nitrogen trifluoride	nf3
1203	NF3-	Nitrogen trifluoride anion	nf3-
1204	NF3+	Nitrogen trifluoride cation	nf3+
1205	PF3	Phosphorus trifluoride	pf3
1206	NCl3	nitrogen trichloride	ncl3
1207	AsF3	Arsenic trifluoride	asf3
1208	PCl3	Phosphorus trichloride	pcl3
1209	SbF3	Antimony Trifluoride	sbf3
1210	AsCl3	Arsenous trichloride	ascl3
1211	SbCl3	Antimony Trichloride	sbcl3
1212	NBr3	Nitrogen Tribromide	nbr3
1213	PBr3	Phosphorus tribromide	pbr3
1214	AsBr3	Arsenic tribromide	asbr3
1215	NI3	Nitrogen triiodide	ni3
1216	PI3	Phosphorus triiodide	pi3
1217	ClSSCl	Disulfur dichloride	s2cl2
1218	BrF3	Bromine trifluoride	brf3
1219	IF3	iodone trifluoride	if3
1220	CHF3	Methane, trifluoro-	chf3
1221	CHF2Cl	difluorochloromethane	chf2cl
1222	SiHF3	trifluorosilane	sihf3
1223	CHFCl2	fluorodichloromethane	chfcl2
1224	CDCl3	trichloromethane-d	cdcl3
1225	CHCl3	Chloroform	chcl3
1226	CHBrF2	Methane, bromodifluoro-	chbrf2
1227	SiHCl3	Trichlorosilane	sihcl3
1228	CHFClBr	fluorochlorobromomethane	chfclbr
1229	CHBrCl2	Methane, bromodichloro-	chbrcl2
1230	CHF2I	difluoroiodomethane	chf2i
1231	CHBr2F	dibromofluoromethane	chbr2f
1232	CHFClI	fluorochloroiodomethane	chfcli
1233	CHCl2I	dichloroiodomethane	chcl2i
1234	CHClBr2	Methane, dibromochloro-	chclbr2
1235	CHBr3	bromoform	chbr3
1236	CHI3	Iodoform	chi3
1237	NF3H+	protonated nitrogen trifluoride	nf3h+
1238	AsF3H+	Arsenic trifluoride, protonated	asf3h+
1239	C2H2F2	Ethene, 1,2-difluoro-, (E)-	c2h2f2e
1240	C2H2F2	Ethene, 1,2-difluoro-, (Z)-	c2h2f2z
1241	CH2CF2	Ethene, 1,1-difluoro-	ch2cf2
1242	C2H2ClF	1-chloro-1-fluoroethylene	c2h2clf
1243	CHFCHCl	(E)-1-chloro-2-fluoroethene	chfchcle
1244	CHFCHClz	(Z)-1-Chloro-2-fluoroethene	chfchclz
1245	CH2CCl2	Ethene, 1,1-dichloro-	ch2ccl2
1246	CHClCHCl	Ethene, 1,2-dichloro-, (E)-	chclchcle
1247	CHClCHCl	Ethene, 1,2-dichloro-, (Z)-	chclchclz
1248	C2H2Br2	1,1-dibromoethene	c2h2br2
1249	CHBrCHBr	Ethene, 1,2-dibromo-, (E)-	chbrchbre
1250	CHBrCHBr	Ethene, 1,2-dibromo-, (Z)-	chbrchbrz
1251	CH2FCHO	Fluoroacetaldehyde	ch2fcho
1252	CH3COF	Acetyl fluoride	ch3cof
1253	CH2ClCHO	chloroacetaldehyde	ch2clcho
1254	CH3COCl	Acetyl Chloride	ch3cocl
1255	C2H4F2	1,2-difluoroethane	c2h4f2
1256	CH3CHF2	Ethane, 1,1-difluoro-	ch3chf2
1257	CH2FCH2Cl	Ethane, 1-chloro-2-fluoro-	ch2fch2cl
1258	CH3CHFCl	Ethane, 1-chloro-1-fluoro-	ch3chfcl
1259	CH2ClCH2Cl	Ethane, 1,2-dichloro-	ch2clch2cl
1260	CH3CHCl2	Ethane, 1,1-dichloro-	ch3chcl2
1261	CH2BrCH2Cl	1-bromo-2-chloroethane	ch2brch2cl
1262	CH2BrCH2Br	Ethane, 1,2-dibromo-	ch2brch2br
1263	CH2CFCH3	2-fluoropropene	2fpro
1264	CH2CHCH2F	Allyl Fluoride	allylf
1265	CH3CHCHF	trans-1-Fluoro-1-propene	propene1ft
1266	C3H5Cl	1-Propene, 3-chloro-	prop1cl3
1267	C3H5Cl	1-chloro-1-propene(E)	prop1cl1e
1268	C3H5Cl	1-chloro-1-propene(Z)	prop1cl1z
1269	CH2FCH2OH	2-fluoroethanol	ch2fch2oh
1270	CH2ClCH2OH	2-Chloroethanol	ch2clch2oh
1271	CH2ClCH2OH2+	2-chloroethanol, protonated	ch2clch2oh2+
1272	CH2FCH2CH3	1-Fluoropropane	prf1
1273	CH3CHFCH3	2-Fluoropropane	prf2
1274	CH2ClCH2CH3	Propane, 1-chloro-	prcl1
1275	CH3CHClCH3	Propane, 2-chloro-	prcl2
1276	CH3CH2CH2Br	n-propyl bromide	prbr
1277	CH3CHBrCH3	i-propyl bromide	iprbr
1278	C3H9O+	trimethyl oxonium cation	c3h9o+
1279	B5H9	pentaborane9	b5h9
1280	C5H4	pentatetraene	ptrene
1281	C5H5	cyclopentadienyl radical	c5h5
1282	C5H5-	cylopentadienyl anion	c5h5-
1283	C5H6	1,3-Cyclopentadiene	c542927
1284	C5H6	1-Buten-3-yne, 2-methyl-	c78808
1285	C5H6	3-Penten-1-yne, (E)-	c2004695
1286	C5H6	3-Penten-1-yne, (Z)-	c1574409
1287	C5H6	Bicyclo[2.1.0]pent-2-ene	c5164352
1288	C5H6	Cyclopropylacetylene	c6746947
1289	C5H6	Propellane	propellane
1290	C5H7	1,3-pentadienyl radical	pdyl
1291	C5H7	cyclopentenyl radical	cpyl
1292	C5H8	1,2-Butadiene, 3-methyl-	c598254
1293	C5H8	1,2-Pentadiene	c591957
1294	C5H8	1,3-Butadiene, 2-methyl-	c78795
1295	C5H8	1,3-Pentadiene, (E)-	c2004708
1296	C5H8	1,3-Pentadiene, (Z)-	c1574410
1297	C5H8	1,4-Pentadiene	c591935
1298	C5H8	1-pentyne	a1pentyne
1299	C5H8	2,3-Pentadiene	c591968
1300	C5H8	Bicyclo[1.1.1]pentane	bcp
1301	C5H8	Cyclobutane, methylene-	c1120565
1302	C5H8	Cyclopentene	c142290
1303	C5H8	Ethenylcyclopropane	c693867
1304	CH3CCCH2CH3	2-Pentyne	2pentyne
1305	C5H10	1-Butene, 2-methyl-	c563462
1306	C5H10	2-Butene, 2-methyl-	c513359
1307	C5H10	2-Pentene, (E)-	c646048
1308	C5H10	2-Pentene, (Z)-	c627203
1309	C5H10	Cyclopentane	c287923
1310	C5H10	Cyclopropane, 1,1-dimethyl-	c1630940
1311	CH2CHCH2CH2CH3	1-pentene	pentene
1312	C5H11	2-Methylbut-2-yl radical	c4348350
1313	C5H12	Butane, 2-methyl-	buta2
1314	C5H12	Pentane	pentane
1315	C5H12	Propane, 2,2-dimethyl-	neopentane
1316	Si(CH3)4	tetramethylsilane	tms
1317	N2O3	Dinitrogen trioxide	n2o3
1318	C3H2N2	Malononitrile	c3h2n2
1319	CH2N4	1H-Tetrazole	1htz
1320	C3H3N2	imidazolyl radical	im
1321	C3H3N2-	imidizolyl anion	im-
1322	C2H3N3	1H-1,2,4-Triazole	c288880
1323	C4H4N	pyrrolide radical	c4h4n
1324	C4H4N-	pyrrolide anion	c4h4n-
1325	C3H4N2	1H-Imidazole	1himidaz
1326	C3H4N2	1H-Pyrazole	1hpyraz
1327	C3H4N2	2H-Imidazole	imid2h
1328	C3H4N2	4H-Imidazole	imid4h
1329	C4H5N	(E)-2-Butenenitrile	c627269
1330	C4H5N	(Z)-2-Butenenitrile	c1190767
1331	C4H5N	2H-pyrrole	pyrrole2
1332	C4H5N	3H-pyrrole	pyrrole3
1333	C4H5N	Cyclopropanecarbonitrile	c5500210
1334	C4H5N	Pyrrole	pyrrole
1335	CH2CHCH2CN	Allylcyanide	ch2chch2cn
1336	C4H6N+	pyrrole, alpha-protonated	appyr
1337	C4H6N+	pyrrole, beta-protonated	bppyr
1338	C4H6N+	pyrrole, protonated	ppyr
1339	C3H6N2	3-Aminopropionitrile	c151188
1340	CH3CH(CH3)CN	Propanenitrile, 2-methyl-	c4h7n
1341	CH3CH2CH2CN	Butanenitrile	c109740
1342	C5H8	Bicyclo[2.1.0]pentane	c185944
1343	C5H8	Spiropentane	c157404
1344	C4H9N	Cyclobutylamine	cbam
1345	C4H9N	Pyrrolidine	pyrrolidine
1346	C3H10N2	1,2-Diaminopropane	diampr12
1347	C(CH3)3NH2	2-Propanamine, 2-methyl-	c75649
1348	C(NH2)H2C(CH3)HCH3	1-Propanamine, 2-methyl-	c78819
1349	C(NH2)H2CH2CH2CH3	1-Butanamine	butam1
1350	CH3C(NH2)HCH2CH3	2-Butanamine	butam2
1351	NH(C2H5)2	diethylamine	dea
1352	NC4H12+	tetramethyl ammonium cation	nc4h12+
1353	C3O2	Carbon suboxide	c3o2
1354	C3O2+	Carbon suboxide cation	c3o2+
1355	B2O3	diboron trioxide	b2o3
1356	MgCO3	Magnesium Carbonate	mgco3
1357	BeCO3	Beryllium Carbonate	beco3
1358	CaCO3	Calcium Carbonate	caco3
1359	ONONO	Nitrosyl nitrite	onono
1360	PO4---	phosphate	po4---
1361	SO4--	sulfate	so4--
1362	HOONO2	peroxy nitric acid	hoono2
1363	HSO4-	bisulfate anion	hso4-
1364	C2H2N2S	1,3,4-Thiadiazole	c2h2n2s
1365	C3H2O2	Propiolic acid	c3h2o2
1366	CHOCOOH	oxo acetic acid	oaa
1367	CHOOCHO	diformyl ether	choocho
1368	H2SO4	Sulfuric acid	h2so4
1369	H2SeO4	Selenic acid	h2seo4
1370	C3H3NO	Isoxazole	isox
1371	C3H3NO	Oxazole	oxazole
1372	C3H3NS	Thiazole	thiazole
1373	CH3C(O)OO	acetyl peroxy radical	ch3coo2
1374	CH3NO3	Methyl nitrate	ch3no3
1375	H3PO4	Phosphoric Acid	h3po4
1376	C4H4O	Furan	furan
1377	C4H4O+	Furan cation	furan+
1378	CH3COCCH	3-butyn-2-one	c1423605
1379	C4H4S	Thiophene	furans
1380	C4H4Se	selenophene	c4h4se
1381	C3H4O2	β–Propiolactone	beta
1382	C3H4O2	2-Propenoic acid	propenoic2
1383	C3H4O2	Methyl glyoxal	megly
1384	C3H4O2	propanedial	propanedial
1385	C3H4O2	propenalol	propenalol
1386	HOCHCCHOH	allenediol	aldiol
1387	C2H4O3	1,2,3-trioxolane	c2h4o3
1388	C2H4O3	trioxolane124	triox
1389	HOCH2COOH	Hydroxyacetic acid	hac
1390	CH2CHCONH2	Acrylamide	c79061
1391	CH3OCH2CN	Methoxyacetonitrile	c1738369
1392	CH5N3S	Hydrazinecarbothioamide	c79196
1393	H2NCH2COOH	Glycine	glycine
1394	CH3SO2NH2	methanesulfonamide	ch3so2nh2
1395	C4H6O	cis-2-butenal	butenal2c
1396	C4H6O	Cyclobutanone	cbutone
1397	C4H6O	Furan, 2,3-dihydro-	furan23h
1398	C4H6O	Furan, 2,5-dihydro-	furan25h
1399	CH2CHOCHCH2	Vinyl ether	vinylether
1400	CHOCHCHCH3	2-Butenal	butenal2
1401	C4H6S	Thiophene, 2,3-dihydro-	thiop23h
1402	C4H6S	Thiophene, 2,5-dihydro-	thiop25h
1403	CH2CHSCHCH2	Divinyl sulfide	divis
1404	C2H6N2O	Urea, methyl-	c598505
1405	C3H6O2	1,3-Dioxolane	dioxolane
1406	CH3CH2COOH	Propanoic Acid	propanoic
1407	CH3COOCH3	methyl acetate	aame
1408	HCOOC2H5	Ethyl formate	faee
1409	CH3SSSCH3	dimethyl trisulfide	c2h6s3
1410	C3H7NO	dimethylformamide	dmf
1411	C3H7NO	Propanamide	propanam
1412	C2H3OC2H5	Ethene, ethoxy-	c109922
1413	C4H8O	Cyclobutanol	c2919235
1414	C4H8O	Furan, tetrahydro-	thf
1415	CH2C(CH3)OCH3	1-Propene, 2-methoxy-	pre1meo2
1416	CH3COCH2CH3	2-Butanone	buta2one
1417	CHOCH(CH3)CH3	Propanal, 2-methyl-	c78842
1418	CHOCH2CH2CH3	Butanal	butanal
1419	C4H8S	Thiophene, tetrahydro-	tht
1420	C3H8O2	1,3-Propanediol	c504632
1421	C3H8O2	Hydroperoxide, 1-methylethyl	c3031752
1422	C3H8O2	Methane, dimethoxy-	c109875
1423	C3H8O2	Propylene glycol	c57556
1424	C3H8S2	1,3-Propanedithiol	c109808
1425	C4H10O	1-Butanol	butanol1
1426	C4H10O	1-Propanol, 2-methyl-	c78831
1427	C4H10O	2-Butanol, (.+/-.)-	butanol2
1428	C4H10O	Ethanol, 1,1-dimethyl-	tbuoh
1429	C4H10O	Ethoxy ethane	etoet
1430	C4H10O	Methyl propyl ether	meopr
1431	C4H10O	Propane, 2-methoxy-	c598538
1432	C4H10O+	1-Butanol cation	butanol1+
1433	C(CH3)3SH	2-Propanethiol, 2-methyl-	tbush
1434	C2H5SC2H5	Diethyl sulfide	etset
1435	C4H9SH	1-Butanethiol	bush
1436	CH2(SH)CH(CH3)CH3	1-Propanethiol, 2-methyl-	c513440
1437	CH3C(SCH3)HCH3	Propane, 2-(methylthio)-	mesipr
1438	CH3CH(SH)CH2CH3	2-Butanethiol	butansl2
1439	FNO3	Fluorine nitrate	fno3
1440	ClONO2	Chlorine nitrate	clono2
1441	BrONO2	Bromine nitrate	brono2
1442	TiCl4	Titanium tetrachloride	ticl4
1443	ClO4-	perchlorate anion	clo4-
1444	BF4-	tetrafluoroboron anion	bf4-
1445	ClFO3	Perchloryl fluoride	clfo3
1446	SO2F2	Sulfuryl fluoride	so2f2
1447	SO2Cl2	Sulfuryl chloride	so2cl2
1448	F3NO	Nitrogen trifluoride oxide	f3no
1449	F3PO	Phosphoryl fluoride	pf3o
1450	Cl3PO	Phosphoryl chloride	pcl3o
1451	CF4	Carbon tetrafluoride	cf4
1452	CF3Cl	Methane, chlorotrifluoro-	cf3cl
1453	SiF4	Silicon tetrafluoride	sif4
1454	TiF4	Titanium tetrafluoride	tif4
1455	CFCl3	Trichloromonofluoromethane	cfcl3
1456	CF3Br	Bromotrifluoromethane	cf3br
1457	GeF4	Germanium tetrafluoride	gef4
1458	CCl4	Carbon tetrachloride	ccl4
1459	CCl4+	Carbon tetrachloride cation	ccl4+
1460	CBrClF2	Methane, bromochlorodifluoro-	cbrclf2
1461	SiCl4	Silane, tetrachloro-	sicl4
1462	CBrCl2F	bromodichlorofluoromethane	cbrcl2f
1463	CF3I	trifluoroiodomethane	cf3i
1464	CBrCl3	Methane, bromotrichloro-	cbrcl3
1465	CBr2F2	Methane, dibromodifluoro-	cbr2f2
1466	GeCl4	Germanium Tetrachloride	gecl4
1467	CBr2ClF	dibromochlorofluoromethane	cbr2clf
1468	CBr2Cl2	dibromodichloromethane	cbr2cl2
1469	CCl3I	trichloroiodomethane	ccl3i
1470	CFBr3	fluorotribromomethane	cfbr3
1471	CFClBrI	fluorochlorobromoiodomethane	cfclbri
1472	CBr3Cl	tribromochloromethane	cbr3cl
1473	CF2I2	difluorodiiodomethane	cf2i2
1474	CBr4	Carbon tetrabromide	cbr4
1475	CCl2I2	dichlorodiiodomethane	ccl2i2
1476	SiBr4	Silicon tetrabromide	sibr4
1477	CBr3I	tribromoiododmethane	cbr3i
1478	GeBr4	Germanium tetrabromide	gebr4
1479	CI4	tetraiodomethane	ci4
1480	SiI4	silicon tetraiodide	sii4
1481	ClOF3	Chlorine trifluoride oxide	clof3
1482	SeF4	Selenium tetrafluoride	sef4
1483	SCl4	Sulfur tetrachloride	scl4
1484	C2HF3	Trifluoroethylene	c2hf3
1485	C2HF3+	Trifluoroethylene cation	c2hf3+
1486	CHClCCl2	Trichloroethylene	chclccl2
1487	CHBrCF2	1-Bromo-2,2-difluoroethylene	chbrcf2
1488	HSO3F	Fluorosulfonic acid	hso3f
1489	CF3OH	trifluoromethanol	cf3oh
1490	CH2ClCCCl	1,3-dichloropropyne	ch2clcccl
1491	CHClCCHCl	1,3-dichloroallene	chclcchcl
1492	CHCl2CCH	3,3-dichloropropyne	chcl2cch
1493	CHCl2CHO	dichloroacetaldehyde	chcl2cho
1494	PF3CH2	phosphorane, trifluoromethylene-	pf3ch2
1495	CH3CF3	Ethane, 1,1,1-trifluoro-	ch3cf3
1496	CHF2CH2F	Ethane, 1,1,2-trifluoro	ch2fchf2
1497	CH3CF2Cl	1-Chloro-1,1-Difluoroethane	ch3cf2cl
1498	CH3CFCl2	1,1-Dichloro-1-fluoroethane	ch3cfcl2
1499	CH2ClCHCl2	1,1,2-trichloroethane	ch2clchcl2
1500	CH3CCl3	Ethane, 1,1,1-trichloro-	ch3ccl3
1501	SiCl3CH3	methyltrichlorosilane	sicl3ch3
1502	CH3CBr3	1,1,1-tribromoethane	ch3cbr3
1503	NH3BCl3	Amminetrichloroboron	nh3bcl3
1504	CH2CClCHCH2	1,3-Butadiene, 2-chloro-	c4h5cl
1505	C3H5ClO	Oxirane, (chloromethyl)-	c106898
1506	CH2FCH2CH2F	1,3-difluoropropane	ch2fch2ch2f
1507	CH3CF2CH3	2,2-difluoropropane	ch3cf2ch3
1508	CH2ClCH2CH2Cl	1,3-dichloropropane	prdicl13
1509	CH2ClCHClCH3	Propane, 1,2-dichloro-	prdicl12
1510	CH3CCl2CH3	Propane, 2,2-dichloro-	prdicl22
1511	CHCl2CH2CH3	1,1-dichloropropane	prdicl11
1512	SiCl2(CH3)2	dichlorodimethylsilane	sicl2me2
1513	CH2CClCH2CH3	1-Butene, 2-chloro-	bute1cl2
1514	CH2CHCH2CH2Cl	1-Butene, 4-chloro-	bute1cl4
1515	CH2CHCHClCH3	1-Butene, 3-chloro-	bute1cl3
1516	CH2ClCHCHCH3	2-Butene, 1-chloro-	bute2cl1
1517	CH3CClCHCH3	2-Butene, 2-chloro-, (E)-	bute2cl2e
1518	CH3CClCHCH3	2-Butene, 2-chloro-, (Z)-	bute2cl2z
1519	CHClCHCH2CH3	(E)-1-Chloro-1-butene	bute1cl1
1520	CHClCHCH2CH3	(Z)-1-Chloro-1-butene	bute1cl1z
1521	C4H9F	1-fluorobutane	butaf1
1522	CH3CHFCH2CH3	2-fluorobutane	butaf2
1523	CH2ClCH2CH2CH3	Butane, 1-chloro-	butacl1
1524	CH3CCl(CH3)CH3	Propane, 2-chloro-2-methyl-	procl2me2
1525	CH3CHClCH2CH3	Butane, 2-chloro-	butacl2
1526	XeF4	Xenon tetrafluoride	xef4
1527	C2H2N2O	Furazan	furazan
1528	CF3PH2	phosphine, (trifluoromethyl)-	cf3ph2
1529	NH3BF3	Amminetrifluoroboron	nh3bf3
1530	C6H2	hexatriyne	c6h2
1531	C6H4	(E)-Hexa-1,5-diyne-3-ene	c6h4e
1532	C6H4	(Z)-Hexa-1,5-diyne-3-ene	c6h4z
1533	C6H4	Benzyne	benzyne
1534	C6H5	phenyl	phenyl
1535	C6H5-	phenyl anion	phenyl-
1536	C6H6	Prismane	prismane
1537	C6H6	1,2,4,5-Hexatetraene	ht1245
1538	C6H6	2,4-Hexadiyne	hexadiyne
1539	C6H6	3,4-Dimethylenecyclobutene	cb34m
1540	C6H6	Benzene	benzene
1541	C6H6	Benzvalene	bv
1542	C6H6	Dewar Benzene	dewar
1543	C6H6	Hexa-1,5-diene-3-yne	hdy153
1544	C6H6	Trimethylenecycopropane	tmcp
1545	C6H6+	Benzene cation	c6h6+
1546	C6H7+	benzene, protonated	c6h7+
1547	C6H8	(E)-hexa-1,3,5-triene	c821078
1548	C6H8	(E)-hexa-2,3,4-triene	c59660650
1549	C6H8	(Z)-hexa-1,3,5-triene	hexatri135
1550	C6H8	(Z)-hexa-2,3,4-triene	hetr234c
1551	C6H8	1,3-Cyclohexadiene	cyhexadiene13
1552	C6H8	1,4-Cyclohexadiene	cyhexadiene14
1553	C6H8	3-Methylenecyclopentene	c930267
1554	C6H8	Bicyclo[2.1.1]hex-2-ene	c822413
1555	C6H8	Bicyclo[2.2.0]hex-1(4)-ene	c30830207
1556	C6H8	Bicyclo[3.1.0]hex-2-ene	c694019
1557	C6H10	1,3-Hexadiene, (E)-	hexdi13e
1558	C6H10	1,3-Hexadiene, (Z)-	hexdi13z
1559	C6H10	1,4-Hexadiene, (E)-	hexdi14t
1560	C6H10	1,4-Hexadiene, (Z)-	hexdi14z
1561	C6H10	1,5-Hexadiene	c592427
1562	C6H10	1-Butyne, 3,3-dimethyl-	c917920
1563	C6H10	1-Hexyne	hexyne1
1564	C6H10	2,4-Hexadiene, (E,E)-	hexdi24ee
1565	C6H10	2,4-Hexadiene, (E,Z)-	hexdi24ez
1566	C6H10	2,4-Hexadiene, (Z,Z)-	hexdi24zz
1567	C6H10	2-Hexyne	c764352
1568	C6H10	3-Hexyne	hexyne3
1569	C6H10	cyclohexene	cyclohexene
1570	C6H10	Cyclopentene, 1-methyl-	c693890
1571	C6H10	Cyclopentene, 3-methyl-	c1120623
1572	C6H10	Cyclopentene, 4-methyl-	c1759815
1573	C4H6(CH3)2	1,1-dimethylcyclobutane	dmcb11
1574	C6H12	(1R,2R)-1,2-dimethylcyclobutane	dmcb12t
1575	C6H12	(1r,3r)-1,3-dimethylcyclobutane	dmcb13t
1576	C6H12	(E)-2-Hexene	e2hexene
1577	C6H12	(E)-3-methylpent-2-ene	c616126
1578	C6H12	(E)-hex-3-ene	e3hexene
1579	C6H12	(Z)-3-methylpent-2-ene	c922623
1580	C6H12	(Z)-hex-2-ene	z2hexene
1581	C6H12	(Z)-hex-3-ene	z3hexene
1582	C6H12	2,3-dimethylbut-1-ene	c563780
1583	C6H12	2,3-dimethyl-but-2-ene	tmeet
1584	C6H12	3-methylenepentane	c760214
1585	C6H12	cis-1,2-dimethylcyclobutane	dmcb12c
1586	C6H12	cis-1,3-dimethylcyclobutane	dmcb13c
1587	C6H12	Cyclohexane	cyclohexane
1588	C6H12	Cyclopentane, methyl-	c96377
1589	C6H12	Ethylcyclobutane	c4806615
1590	C6H12	hex-1-ene	hexene1
1591	C6H14	Butane, 2,2-dimethyl-	buta22
1592	C6H14	Butane, 2,3-dimethyl-	buta23
1593	C6H14	Hexane	hexane
1594	C6H14	Pentane, 2-methyl-	penta2
1595	C6H14	Pentane, 3-methyl-	penta3
1596	C4N2	2-Butynedinitrile	c4n2
1597	N3P3	1,3,5,2,4,6-Triazatriphosphorine	n3p3
1598	C4H2N2	Fumaronitrile	c4h2n2
1599	C2H2N4	sym-tetrazine	ttz
1600	C3H3N3	1,3,5-Triazine	triazine135
1601	CH3N5	5-Aminotetrazole	c4418615
1602	C4H4N2	1,3-Diazine	diazine13
1603	C4H4N2	Pyrazine	pyrazine
1604	C4H4N2	Pyridazine	pyridazine
1605	C4H4N2	Succinonitrile	c110612
1606	C2H4N4	1H-Tetrazole, 1-methyl-	c16681779
1607	C2H4N4	1H-Tetrazole, 5-methyl-	c4076362
1608	C2H4N4	2H-Tetrazole, 2-methyl-	c16681780
1609	C5H5N	Bicyclo[1.1.0]butane-1-carbonitrile	bibucn
1610	C5H5N	E-2,4-pentadienenitrile	bdcn
1611	C5H5N	Pyridine	pyridine
1612	B3N3H6	borazine	borazine
1613	C6H6	Fulvene	fulvene
1614	C5H6N+	Pyridinium	c5h6n
1615	C4H6N2	1H-Imidazole, 2-methyl-	c693981
1616	C5H7N	(E)-2-Pentenenitrile	c26294984
1617	C5H7N	(E)-3-Pentenenitrile	c16529661
1618	C5H7N	(Z)-2-Pentenenitrile	c25899507
1619	C5H7N	1H-Pyrrole, 1-methyl-	c96548
1620	C5H7N	Cyclobutanecarbonitrile	c4426113
1621	C5H9N	1,2,3,6-Tetrahydropyridine	c694053
1622	C5H9N	Butanenitrile, 2-methyl-	c18936179
1623	C5H9N	Pentanenitrile	c110598
1624	C5H9N	Propanenitrile, 2,2-dimethyl-	c630182
1625	C6H10	Bicyclo[3.1.0]hexane	c285585
1626	C5H11N	Cyclopentanamine	cypentam
1627	C5H11N	Piperidine	piper
1628	C4H12N2	1,2-Butanediamine	c4426486
1629	C4H12N2	2-Methyl-1,2-propanediamine	c811938
1630	Li2CO3	Lithium Carbonate	li2co3
1631	Na2CO3	Sodium Carbonate	na2co3
1632	C2O4--	oxalate anion	c2o4
1633	MgSO4	Magnesium Sulfate	mgso4
1634	N2O4	Dinitrogen tetroxide	n2o4
1635	C3H2O3	vinylene carbonate	vica
1636	C2H2O4	Oxalic Acid	oxalic
1637	C2H3NO3	Oxamic acid	oxamic
1638	C4H4O2	2(5H)-Furanone	furanone
1639	C4H4O2	2-Oxetanone, 4-methylene-	c674828
1640	C2H4N2O2	Oxalamide	oxalamide
1641	C2H4N2S2	Ethanedithioamide	c79403
1642	C2H4CO3	Ethylene carbonate	etco3
1643	C3H4O2S	2H-Thiete-1,1-dioxide	c7285327
1644	C3H4S3	1,3-Dithiolane-2-thione	c822388
1645	C2H4O4	Formic acid dimer	fadimer
1646	C4H5NO	3-Methylisoxazole	isox3m
1647	C4H5NO	Isoxazole, 5-methyl-	c5765446
1648	C4H5NS	4-Methylthiazole	c693958
1649	C2H5NO3	Nitric acid, ethyl ester	c625581
1650	C5H6O	2H-Pyran	pyran2
1651	C5H6O	2-methylfuran	furan2m
1652	C5H6O	3-Methylfuran	furan3m
1653	C5H6O	Pentadienal	pdal
1654	C5H6S	Thiophene, 2-methyl-	c554143
1655	C5H6S	Thiophene, 3-methyl-	c616444
1656	C4H6O2	γ–Butyrolactone	c96480
1657	C4H6O2	2,3-Butanedione	c431038
1658	C4H6O2	2-Propenoic acid, methyl ester	c96333
1659	C4H6O2	Crotonic Acid	crot
1660	C4H6OS	2,3-dihydrothiophene-2-ol	c9000117
1661	C4H6OS	2,5-dihydrothiophene-3-ol	c9000093
1662	C4H6OS	4,5-dihydrothiophene-2-ol	c9000106
1663	C4H6OS	4,5-dihydrothiophene-3-ol	c9000082
1664	C4H6OS	Dihydro-2-(3H)-thiophenone	c1003107
1665	C4H6OS	Dihydro-3-(2H)-thiophenone	c1003049
1666	C4H6OS	Vinyl sulfoxide	c1115157
1667	CH6N4S	Carbonothioic dihydrazide	thiacarb
1668	C2H6N2O2	(E)-Azodioxymethane	c37765154
1669	C2H6N2O2	Dimethylnitroamine	c4164287
1670	C3H6O3	1,3,5-Trioxane	trioxane
1671	C3H6S3	1,3,5-Trithiane	c3h6s3
1672	C3H6S3	Carbonotrithioic acid, dimethyl ester	c2314489
1673	C2H6O3S	Sulfurous acid, dimethyl ester	c616422
1674	C4H7NO	2-Pyrrolidinone	c616455
1675	C4H7NO	Ethoxyacetonitrile	etoaccn
1676	C4H7NO	Methacrylamide	c79390
1677	C4H7NO	Oxazole, 4,5-dihydro-2-methyl-	c1120645
1678	HCONH2CN2H4	formamide aminomethanimine dimer	d13
1679	C3H7ONO	Propyl nitrite	prono
1680	CH3CH(CH3)ONO	Isopropyl nitrite	c541424
1681	CH3CH(NH2)COOH	Alanine	alanine
1682	CH3NHCH2COOH	Sarcosine	sarcosine
1683	NH2CH2CH2COOH	β–alanine	betaalanine
1684	NH2COOC2H5	Urethane	urethane
1685	C5H8O	2H-Pyran, 3,4-dihydro-	c110872
1686	C5H8O	Cyclopentanone	c120923
1687	C5H8O	Furan, 2,3-dihydro-5-methyl-	c1487156
1688	C5H8O	Methyl cyclopropyl ketone	c765435
1689	N(CH3)2CONH2	Urea, N,N-dimethyl-	c598947
1690	NH(CH3)CONH(CH3)	Urea, N,N'-dimethyl-	c96311
1691	NH2CONHC2H5	Urea, ethyl-	c625525
1692	C4H8O2	1,3-Dioxane	dioxan13
1693	C4H8O2	1,3-Dioxolane, 2-methyl-	c497267
1694	C4H8O2	1,4-Dioxane	dioxan14
1695	C4H8O2	Ethene, 1,1-dimethoxy-	c922690
1696	C4H8O2	Ethyl acetate	c141786
1697	C4H8OS	s-Ethyl thioacetate	c625605
1698	C3H8O3	1,2,3-Propanetriol	glycerin
1699	C3H8O2S	(Methylsulfonyl)ethane	c594434
1700	C4H9NO	Butanamide	c541355
1701	C4H9NO	Propanamide, 2-methyl-	c563837
1702	C5H10O	2-Butanone, 3-methyl-	c563804
1703	C5H10O	2H-Pyran, tetrahydro-	c142687
1704	C5H10O	2-methylbutyraldehyde	2meba
1705	C5H10O	2-Pentanone	mpk
1706	C5H10O	3-Pentanone	dek
1707	C5H10O	Cyclopentanol	c96413
1708	C5H10O	Oxetane, 3,3-dimethyl-	c6921353
1709	C5H10O	Pentanal	pal
1710	C5H10S	2H-Thiopyran, tetrahydro-	c1613510
1711	C5H10S	3-Ethylthio-1-propene	c5296628
1712	C5H10S	Cyclopentanethiol	c1679078
1713	C5H10S	Thiophene, tetrahydro-2-methyl-	c1795091
1714	C5H10S	Thiophene, tetrahydro-3-methyl-	c4740005
1715	C4H10O2	1,1-Dimethoxyethane	c534156
1716	C4H10O2	1,3-Butanediol	budiol13
1717	C4H10O2	1,4-Butanediol	budiol14
1718	C4H10O2	Ethane, 1,2-dimethoxy-	c110714
1719	C4H10OS	Diethyl sulfoxide	c70291
1720	C4H10S2	1,4-Butanedithiol	budisl14
1721	C4H11NO	Diethylhydroxylamine	c3710847
1722	C5H12O	1-Butanol, 2-methyl-	c137326
1723	C5H12O	1-Butanol, 3-methyl-	c123513
1724	C5H12O	1-Pentanol	pentanol1
1725	C5H12O	2-Butanol, 3-methyl-	c598754
1726	C5H12O	2-Pentanol	peol2
1727	C5H12O	3-Pentanol	pentan3ol
1728	C5H12O	Butane, 1-methoxy-	meobu
1729	C5H12O	Propane, 1-ethoxy-	proet
1730	C5H12O	Propane, 2-methoxy-2-methyl-	c1634044
1731	C5H12S	1-Butanethiol, 2-methyl-	c1878188
1732	C5H12S	1-Butanethiol, 3-methyl-	c541311
1733	C5H12S	1-Pentanethiol	c110667
1734	C5H12S	1-Propanethiol, 2,2-dimethyl-	c1679089
1735	C5H12S	2-Butanethiol, 2-methyl-	c1679090
1736	C5H12S	2-Butanethiol, 3-methyl-	c2084186
1737	C5H12S	Butane, 1-(methylthio)-	c628295
1738	C5H12S	Ethyl propyl sulfide	c4110503
1739	C5H12S	Propane, 2-(ethylthio)-	c5145993
1740	C5H12S	Propane, 2-methyl-2-(methylthio)-	c6163640
1741	C4F2	difluorobutadiyne	c4f2
1742	ClCOClCO	Oxalyl chloride	oxcl
1743	CF3CN	Acetonitrile, trifluoro-	cf3cn
1744	CF3CN+	Acetonitrile, trifluoro- cation	cf3cn+
1745	B2F4	Diboron tetrafluoride	b2f4
1746	B2Cl4	Diboron tetrachloride	b2cl4
1747	C2F4	Tetrafluoroethylene	c2f4
1748	C2F4+	Tetrafluoroethylene cation	c2f4+
1749	C2ClF3	Ethene, chlorotrifluoro-	c2f3cl
1750	CF2CCl2	difluorodichloroethylene	cf2ccl2
1751	CFClCClF	trans-1,2-dichloro-1,2-difluoroethylene	cfclcclf
1752	CFClCFCl	cis-1,2-dichloro-1,2-difluoroethylene	cfclcfcl
1753	C2FCl3	fluorotrichloroethene	c2fcl3
1754	C2Cl4	Tetrachloroethylene	c2cl4
1755	C2Br4	tetrabromoethene	c2br4
1756	CF3OF	Trifluoromethylhypofluorite	cf3of
1757	AsF5	Arsenic pentafluoride	asf5
1758	PCl5	Phosphorus pentachloride	pcl5
1759	SF5	Sulfur pentafluoride	sf5
1760	SF5+	pentafluoro sulfur cation	sf5+
1761	SbCl5	Antimony pentachloride	sbcl5
1762	BrF5	bromine pentafluoride	brf5
1763	ClF5	chlorinepentafluoride	clf5
1764	IF5	pentafluoroiodine	if5
1765	CF3CHO	trifluoroacetaldehyde	cf3cho
1766	CCl3CHO	trichloroacetaldehyde	ccl3cho
1767	CHFClCHClF	ethane, 1,2-dichloro-1,2-difluoro-	chfclchclf
1768	CF3CH2F	1,1,1,2-tetrafluoroethane	cf3ch2f
1769	CHF2CHF2	1,1,2,2-tetrafluoroethane	chf2chf2
1770	CF3CH2Cl	2,2,2-Trifluoroethyl chloride	cf3ch2cl
1771	CHFClCHFCl	1,2-dichloro-1,2-difluoroethane RR	chfclchfcl
1772	CH2ClCCl3	1,1,1,2-tetrachloroethane	ch2clccl3
1773	CH2BrCBr3	1,1,1,2-tetrabromo ethane	c2h2br4
1774	CHCl2CHF2	1,1-dichloro-2,2-difluoroethane	c2h2cl2f2
1775	CF3COOH	trifluoroacetic acid	cf3cooh
1776	C4H3ClO	Furan, 2-chloro	fur2cl
1777	C4H3ClO	Furan,3-chloro	fur3cl
1778	C3H5ClO2	Carbonochloridic acid, ethyl ester	c541413
1779	C3H5Cl3	Propane, 1,2,3-trichloro-	prcl135
1780	C4H8Cl2	1,4-Dichlorobutane	c110565
1781	C4H8Cl2	Butane, 1,2-dichloro-	c616217
1782	C4H8Cl2	Butane, 1,3-dichloro-	c1190223
1783	C4H8Cl2	Butane, 2,3-dichloro-, (r*,r*)-(.+/-.)-	c2211678
1784	C4H8Cl2	Butane, 2,3-dichloro-, (r*,s*)-	c4028562
1785	C4H9ClO	1-Chloro-2-ethoxyethane	c628342
1786	C5H11Cl	Pentane, 1-chloro-	pencl1
1787	C4H8O2	Butanoic acid	bua
1788	C6H5CH2	benzyl radical	benzyl
1789	C7H7	cycloheptatrienyl radical	c7h7
1790	C7H7+	cycloheptatrienyl cation	c7h7+
1791	C6H5CH3	toluene	toluene
1792	C7H8	cycloheptatriene	cht
1793	C7H8	Norbornadiene	norbor
1794	C7H8	Quadricyclane	qucy
1795	C7H12	Norbornane	nor
1796	C7H14	cycloheptane	c7h14
1797	C7H16	2-methylhexane	2mhex
1798	C7H16	3-methylhexane	hex3m
1799	C7H16	heptane	heptane
1800	CH(CN)3	tricyanomethane	mecn3
1801	HN=C=C(CN)2	Dicyanoketenimine	c4hn3
1802	C6H7N	2-Methylpyridine	mp
1803	C6H5NH2	aniline	aniline
1804	C6H13N	2-Methylpiperidine	pip2m
1805	C6H13N	cyclohexanamine	cham
1806	C6H15N	triethylamine	tea
1807	N2O5	Dinitrogen pentoxide	n2o5
1808	C4H2O3	Maleic Anhydride	malan
1809	C5H4O2	4-Cyclopentene-1,3-dione	cpdio
1810	C5H4O2	furfural	furfural
1811	C6H5O	phenoxy radical	phenoxy
1812	C5H5NO	2(1H)-Pyridinone	c72762006
1813	C5H5NO	2(3H)-Pyridinone	c9000048
1814	C5H5NO	2(5H)-Pyridinone	c9000037
1815	C5H5NO	2-Pyridinol	c109104
1816	C5H5NO	3(2H)-Pyridinone	c9000004
1817	C5H5NO	3(4H)-Pyridinone	c9000026
1818	C5H5NO	3(6H)-Pyridinone	c9000015
1819	C5H5NO	3-Pyridinol	c109002
1820	C5H5NO	4(1H)-Pryidinone	c9000060
1821	C5H5NO	4(3H)-Pryidinone	c9000059
1822	C5H5NO	4-Pyridinol	c626642
1823	C6H5OH	phenol	phenol
1824	C6H6O	2,4-Cyclohexadienone	c24599573
1825	C6H6O	2,5-Cyclohexadienone	c5664335
1826	C6H5SH	Benzenethiol	phsh
1827	HO2CCHNH2CH2OH	Serine	serine
1828	C5H8O2	Acetylacetone	acac
1829	C4H8O2S	Sulfolane	sulfolane
1830	C7H10	Norbornene	norbornene
1831	CH(C2H3)3	trivinyl methane	tvm
1832	C6H10O	cyclohexanone	chexo
1833	C6H12O	hexanal	c6h12o
1834	C6H12O	Oxepane	oxepane
1835	C3H7OC3H7	di-n-propyl ether	propr
1836	F2CCCF2	tetrafluoroallene	pfa
1837	CF3COO-	trifluoro acetate anion	cf3coo-
1838	CF3COF	trifluoroacetyl fluoride	cf3cof
1839	CF3COCl	trifluoroacetyl chloride	cf3cocl
1840	PF6	Hexafluorophosphate neutral	pf6
1841	SF6	Sulfur Hexafluoride	sf6
1842	SeF6	Selenium hexafluoride	sef6
1843	CF3CHF2	pentafluoroethane	cf3chf2
1844	CF3CHFCl	1,1,1,2-tetrafluorochloroethane	cf3chfcl
1845	CF3CHCl2	1,1-Dichloro-2,2,2-trifluoroethane	cf3chcl2
1846	CHCl2CClF2	Ethane, 1,2,2-trichloro-1,1-difluoro-	chcl2cclf2
1847	CCl3CHCl2	pentachloroethane	ccl3chcl2
1848	C6H5F	Fluorobenzene	bzf
1849	C6H5Cl	chlorobenzene	bzcl
1850	C6H5Br	bromobenzene	bzbr
1851	C8H6	Calicene	calicene
1852	C6H5CCH	phenylacetylene	phac
1853	C8H6	benzocyclobutadiene	bcbd
1854	C8H6	Pentalene	pentalene
1855	C6H5CHCH2	Styrene	styrene
1856	C8H8	cubane	cubane
1857	C8H8	cyclooctatetraene	cot
1858	C6H5CH2CH3	Ethylbenzene	etbz
1859	CH3C6H4CH3	meta-xylene	mxylene
1860	CH3C6H4CH3	paraxylene	pxylene
1861	C8H14	Bicyclo[2.2.2]octane	bico222
1862	C8H16	cyclooctane	cyclooct
1863	(CH3)3CC(CH3)3	tetramethylbutane	tmb
1864	C8H18	Octane	c8h18
1865	C6H5CN	phenyl cyanide	phcn
1866	C6H12N2	Triethylenediamine	ted
1867	C4O4--	squarate dianion	c4o4--
1868	S4N4	Tetrasulfur tetranitride	s4n4
1869	S8	Octasulfur	s8
1870	C6H4O2	parabenzoquinone	pbq
1871	C4H4N2O2	Uracil	uracil
1872	C6H5CHO	benzaldehyde	benzal
1873	C6H5OCH3	Anisole	anisole
1874	C5H9NO2	Proline	proline
1875	C6H12O2	Methyl pivalate	c598981
1876	C6H12O2	Hexanoic acid	hexa
1877	C4F4	tetrafluorcyclobutadiene	c4f4
1878	CF3CF2Cl	pentafluorochloroethane	cf3cf2cl
1879	CF2ClCF2Cl	1,2-Dichloro-1,1,2,2-tetrafluoroethane	cf2clcf2cl
1880	CF3CFCl2	1,1-Dichlorotetrafluoroethane	cf3cfcl2
1881	CF2ClCFCl2	Ethane, 1,1,2-trichloro-1,2,2-trifluoro-	cf2clcfcl2
1882	CF3CCl3	1,1,1-trifluoro-2,2,2-trichloroethane	cf3ccl3
1883	C2F6	hexafluoroethane	c2f6
1884	C2Cl6	hexachloroethane	c2cl6
1885	IF7	Iodine heptafluoride	if7
1886	C6H4F2	metadifluorobenzene	mdfb
1887	C6H4F2	orthodifluorobenzene	odfb
1888	C6H4F2	1,4-difluorobenzene	pdfb
1889	C6H4Cl2	1,2-dichlorobenzene	dcb12
1890	C6H4Cl2	1,3-dichlorobenzene	dcb13
1891	C6H4Cl2	1,4-dichlorobenzene	dcb14
1892	C6H5NO	nitrosobenzene	bzno
1893	C9H8	Indene	indene
1894	C9H8	spiro[4.4]nona-1,3,6,8-tetraene	snt
1895	C9H12	n-propyl benzene	prbz
1896	C9H20	Nonane	nonane
1897	C(CN)4	tetracyanomethane	c5n4
1898	C5H4N4	purine	purine
1899	C8H7N	Indole	indole
1900	C3H3N3O3	cyanuric acid	cyanuric
1901	C6H5NO2	Nitrobenzene	c6h5no2
1902	C6H5COOH	benzoic acid	benzo
1903	CH3COC6H5	acetophenone	acph
1904	C3Cl3N3	1,3,5-Triazine, 2,4,6-trichloro-	c3cl3n3
1905	C3F6	hexafluoropropene	c3f6
1906	C6H3F3	Benzene trifluoride 123	bzf3a
1907	C8H18O	1-Octanol	octanol
1908	C10H8	Azulene	azu
1909	C10H8	naphthalene	naph
1910	C10H10	bullvalene	bullv
1911	C10H16	adamantane	adamantane
1912	C6N4	Tetracyanoethylene	tcne
1913	C6N4-	tetracyanoethylene anion	tcne-
1914	C10H22	Decane	decane
1915	C4F6	perfluorobutadiene	c4f6
1916	SF5CF3	Sulfur, pentafluoro(trifluoromethyl)-	sf5cf3
1917	C3F8	perfluoropropane	c3f8
1918	Fe(CO)5	Iron pentacarbonyl	ipc
1919	Fe(C5H5)2	ferrocene	fecp2
1920	B12H12--	Dodecahydrododecaborate(2-)	b12h12--
1921	B12H12--	Dodecahydrododecaborate(2-)	b12h12--
1922	C12H8	Acenaphthylene	acenaph
1923	C12H8	biphenylene	biph
1924	C12H10	biphenyl	biphenyl
1925	C12H10	Heptalene	heptalene
1926	C6H12O6	Inositol	inositol
1927	C6F6	hexafluorobenzene	c6f6
1928	S2F10	disulphur decafluoride	s2f10
1929	C13H10	Fluorene	fluorene
1930	C14H10	Anthracene	anth
1931	C14H10	Phenanthrene	phenanthrene
1932	C14H14	Bibenzyl	bibenzyl
1933	C12H10N2	azobenzene	azobenzene
1934	C6H5COC6H5	benzophenone	benzophenone
1935	C16H10	Pyrene	pyrene
1936	C18H12	Tetracene	tetracene
1937	C19H16	Triphenylmethane	tpm
1938	C24H12	Coronene	coronene
1939	C60	Buckminsterfullerene	c60