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 MP4 /STO-3G

Jump to calculations not yet done

count	Species	Name	State	Conformation
1	H2	Hydrogen diatomic	1Σg	D∞h
2	Li	Lithium atom	2S	Kh
3	Na	Sodium atom	2S	Kh
4	K	Potassium atom	2S	Kh
5	LiH	Lithium Hydride	1Σ	C∞v
6	Be	Beryllium atom	1S	Kh
7	Be+	Beryllium atom cation	2S	Kh
8	Mg	Magnesium atom	1S	Kh
9	Mg+	Magnesium atom cation	2S	Kh
10	Ca	Calcium atom	1S	Kh
11	CaH	Calcium monohydride	2Σ	C∞v
12	B	Boron atom	2P	Kh
13	B	Boron atom	4P	Kh
14	B+	Boron atom cation	1S	Kh
15	Al	Aluminum atom	2P	Kh
16	Al+	Aluminum atom cation	1S	Kh
17	C	Carbon atom	3P0	Kh
18	C+	Carbon atom cation	2P	Kh
19	Si	Silicon atom	3P	Kh
20	Si	Silicon atom	1S	Kh
21	Si+	Silicon atom cation	2P	Kh
22	CH4	Methane	1A1	Td
23	N	Nitrogen atom	4S	Kh
24	N	Nitrogen atom	2D	Kh
25	N+	Nitrogen atom cation	3P	Kh
26	P	Phosphorus atom	4S	Kh
27	NH3	Ammonia	1A1	C3v
28	O	Oxygen atom	3S	Kh
29	O+	Oxygen atom cation	4S	Kh
30	S	Sulfur atom	3P	Kh
31	Se	Selenium atom	3P	Kh
32	OH	Hydroxyl radical	2Π	C∞v
33	H2O	Water	1A1	C2v
34	F	Fluorine atom	2P	Kh
35	F+	Fluorine atom cation	3S	Kh
36	Cl+	Chlorine atom cation	3P	Kh
37	HF	Hydrogen fluoride	1Σ	C∞v
38	HCl	Hydrogen chloride	1Σ	C∞v
39	Na2	Sodium diatomic	1Σg	D∞h
40	C2H2	Acetylene	1Σg	D∞h
41	C2H4	Ethylene	1Ag	D2h
42	C2H6	Ethane	1A1g	D3d
43	BN	boron nitride	3Π	C∞v
44	AlN	Aluminum nitride	3Πi	C∞v
45	N2	Nitrogen diatomic	1Σg	D∞h
46	N2H2	(E)-diazene	1Ag	C2h
47	CH2PH	Phosphaethene	1A'	Cs
48	CaO	Calcium monoxide	1Σ	C∞v
49	BO-	boron monoxide anion	1Σ	C∞v
50	CO	Carbon monoxide	1Σ	C∞v
51	CSe	Carbon monoselenide	1Σ	C∞v
52	NO	Nitric oxide	2Π	C∞v
53	O2	Oxygen diatomic	3Σg	D∞h
54	SeO	Selenium monoxide	3Σ	C∞v
55	SeS	Selenium monosulfide	3Σ	C∞v
56	CaOH	Calcium monohydroxide	2Σ+	C∞v
57	H2CO	Formaldehyde	1A1	C2v
58	LiBr	Lithium Bromide	1Σ	C∞v
59	NaBr	Sodium Bromide	1Σ	C∞v
60	CaF	Calcium monofluoride	2Σ	C∞v
61	CaCl	calcium monochloride	2Σ	C∞v
62	BF	Boron monofluoride	1Σ	C∞v
63	CF-	carbon monofluoride anion	3Σ	C∞v
64	F2	Fluorine diatomic	1Σg	D∞h
65	Cl2	Chlorine diatomic	1Σg	D∞h
66	HOBr	Hypobromous acid	1A'	Cs
67	C3H5	Allyl radical	2A2	C2v
68	C3H6	Cyclopropane	1A1'	D3h
69	CH2CHCH3	Propene	1A'	Cs
70	CH2NN	diazomethane	1A1	C2v
71	NH2CN	cyanamide	1A'	Cs
72	NHCHNH2	aminomethanimine	1A	C1
73	Li2O	dilithium oxide	1Σg	D∞h
74	CO2	Carbon dioxide	1Σg	D∞h
75	SO2	Sulfur dioxide	1A1	C2v
76	C2H2O	Oxirene	1A1	C2v
77	HCCOH	ethynol	1A'	Cs
78	FCN	Cyanogen fluoride	1Σ	C∞v
79	HCCF	Fluoroacetylene	1Σ	C∞v
80	C2H3Br	vinyl bromide	1A'	Cs
81	C2H5F	fluoroethane	1A'	Cs
82	C2H5Br	Ethyl bromide	1A'	Cs
83	C4	Carbon tetramer	3Σg	D∞h
84	NO3	Nitrogen trioxide	2B2	one long, two short
85	CH2CHCHO	Acrolein	1A'	Cs
86	C2F2	difluoroacetylene	1Σg	D∞h
87	BF3	Borane, trifluoro-	1A'	D3h
88	AlF3	Aluminum trifluoride	1A1'	D3h
89	NI3	Nitrogen triiodide
90	CaCO3	Calcium Carbonate	1A1	C2v
91	TiCl4	Titanium tetrachloride	1A1	Td
92	SF4	Sulfur tetrafluoride	1A1	C2v
93	C6H6	Fulvene	1A1	C2v
94	C2Cl6	hexachloroethane	1A1g	D3d

Species NOT done yet

count	Species	Name	file name	problem
1	D	Deuterium atom	d
2	D-	Deuterium atom anion	d-
3	D+	Deuterium atom cation	d+
4	H	Hydrogen atom	h
5	H-	Hydrogen atom anion	h-
6	H+	Hydrogen atom cation	h+
7	D2	Deuterium diatomic	d2
8	H2-	hydrogen diatomic anion	h2-
9	H2+	Hydrogen cation	h2+
10	HD	Deuterium hydride	hd
11	H3+	hydrogen trimer cation	h3+
12	He	Helium atom	he
13	He-	Helium atom anion	he-
14	He+	Helium atom cation	he+
15	HeH	Helium hydride	heh
16	HeH+	Helium hydride cation	heh+
17	He2+	helium diatomic cation	he2+
18	Li-	Lithium atom anion	li-
19	Li+	Lithium atom cation	li+
20	Na-	Sodium atom anion	na-
21	Na+	Sodium atom cation	na+
22	K-	Potassium atom anion	k-
23	K+	Potassium atom cation	k+
24	Cu	Copper atom	cu
25	Cu-	Copper atom anion	cu-
26	Cu+	Copper atom cation	cu+
27	LiH-	lithium hydride anion	lih-
28	LiH+	lithium hydride cation	lih+
29	NaH	sodium hydride	nah
30	NaH-	sodium hydride anion	nah-
31	NaH+	sodium hydride cation	nah+
32	KH	Potassium hydride	kh
33	KH+	Potassium hydrogen cation	kh+
34	CuH	Copper monohydride	cuh
35	Be-	Beryllium atom anion	be-
36	Mg-	Magnesium atom anion	mg-
37	Ca-	Calcium atom anion	ca-
38	Ca+	Calcium atom cation	ca+
39	Zn	Zinc atom	zn
40	Zn-	Zinc atom anion	zn-
41	Zn+	Zinc atom cation	zn+
42	BeH	beryllium monohydride	beh
43	BeH-	berylium monohydride anion	beh-
44	BeH+	beryllium monohydride cation	beh+
45	MgH	magnesium monohydride	mgh
46	MgH-	magnesium monohydride anion	mgh-
47	MgH+	magnesium monohydride cation	mgh+
48	CaH+	Calcium monohydride cation	cah+
49	TiH	Titanium monohydride	tih
50	ZnH	Zinc monohydride	znh
51	ZnH+	Zinc, protonated	znh+
52	BeH2	beryllium dihydride	beh2
53	BeH2+	Beryllium dihydride cation	beh2+
54	MgH2	magnesium dihydride	mgh2
55	CaH2	Calcium Hydride	cah2
56	ZnH2	Zinc hydride	znh2
57	B-	Boron atom anion	b-
58	Al-	Aluminum atom anion	al-
59	Sc	Scandium atom	sc
60	Sc+	Scandium cation	sc+
61	Ga	Gallium atom	ga
62	Ga-	Gallium atom anion	ga-
63	Ga+	Gallium atom cation	ga+
64	BH	Boron monohydride	bh
65	BH-	boron monohydride anion	bh-
66	BH+	boron monohydride cation	bh+
67	AlH	aluminum monohydride	alh
68	AlH-	aluminum monohydride anion	alh-
69	AlH+	aluminum monohydride cation	alh+
70	ScH	Scandium monohydride	sch
71	ScH+	Scandium monohydride cation	sch+
72	GaH	Gallium monohydride	gah
73	GaH+	Gallium monohydride cation	gah+
74	BH2	boron dihydride	bh2
75	BH2-	boron dihydride anion	bh2-
76	BH2+	Boron dihydride cation	bh2+
77	AlH2	aluminum dihydride	alh2
78	AlH2-	aluminum dihydride anion	alh2-
79	AlH2+	aluminum dihydride cation	alh2+
80	BH3	boron trihydride	bh3
81	BH3-	boron trihydride anion	bh3-
82	BH3+	boron trihydride cation	bh3+
83	AlH3	aluminum trihydride	alh3
84	AlH3-	aluminum trihydride anion	alh3-
85	AlH3+	aluminum trihydride cation	alh3+
86	ScH3	Scandium trihydride	sch3
87	GaH3	Gallium trihydride	gah3
88	BH4	borohydride	bh4
89	BH4-	borohydride anion	bh4-
90	AlH4-	Aluminum tetrahydride anion	alh4-
91	C-	Carbon atom anion	c-
92	Si-	Silicon atom anion	si-
93	Ti	Titanium atom	ti
94	Ti-	Titanium atom anion	ti-
95	Ti+	Titanium atom cation	ti+
96	Ge	Germanium atom	ge
97	Ge-	Germanium anion	ge-
98	Ge+	Germanium cation	ge+
99	Sn	Tin atom	sn
100	Sn+	Tin cation	sn+
101	CH	Methylidyne	ch
102	CH-	methylidyne anion	ch-
103	CH+	Methylidyne cation	ch+
104	SiH	Silylidyne	sih
105	SiH-	silicon monohydride anion	sih-
106	SiH+	silicon monohydride cation	sih+
107	GeH	germylidene	geh
108	GeH+	Germaniun monohyrdide cation	geh+
109	CH2	Methylene	ch2
110	CH2-	methylene anion	ch2-
111	CH2+	methylene cation	ch2+
112	SiH2	silicon dihydride	sih2
113	SiH2-	silicon dihydride anion	sih2-
114	SiH2+	silicon dihydride cation	sih2+
115	GeH2	germylene	geh2
116	GeH2-	germylene anion	geh2-
117	CH3	Methyl radical	ch3
118	CH3-	methyl anion	ch3-
119	CH3+	methyl cation	ch3+
120	SiH3	Silyl radical	sih3
121	SiH3-	Silyl anion	sih3-
122	SiH3+	Silyl cation	sih3+
123	GeH3	Germyl radical	geh3
124	GeH3+	germyl cation	geh3+
125	CD4	methane-d4	cd4
126	CH2D2	methane-d2	ch2d2
127	CH3D	methane-d	ch3d
128	CH4-	Methane anion	ch4-
129	CH4+	Methane cation	ch4+
130	CHD3	methane-d3	chd3
131	SiH2D2	silane-d2	sih2d2
132	SiH4	Silane	sih4
133	SiH4+	Silane cation	sih4+
134	GeH4	Germane	geh4
135	SnH4	Stannane	snh4
136	SiH5+	Silane, protonated	sih5+
137	N-	Nitrogen atom anion	n-
138	P-	Phosphorus atom anion	p-
139	P+	Phosphorus atom cation	p+
140	V	Vanadium atom	v
141	V+	Vanadium atom cation	v+
142	As	Arsenic atomic	as
143	As-	Arsenic anion	as-
144	As+	Arsenic cation	as+
145	Sb	Antimony atom	sb
146	NH	Imidogen	nh
147	NH-	Imidogen anion	nh-
148	NH+	imidogen cation	nh+
149	PH	phosphorus monohydride	ph
150	PH-	phosphorus monohydride anion	ph-
151	PH+	phosphorus monohydride cation	ph+
152	AsH	Arsenic monohydride	ash
153	AsH+	Arsenic monohydride cation	ash+
154	SbH	Antimony monohydride	sbh
155	ND2	Amidogen-d2	nd2
156	NH2	Amino radical	nh2
157	NH2-	amino anion	nh2-
158	NH2+	Amino cation	nh2+
159	PH2	Phosphino radical	ph2
160	PH2-	Phosphino anion	ph2-
161	PH2+	Phosphino cation	ph2+
162	AsH2	Arsenic dihydride	ash2
163	AsH2+	Arsenic dihydride cation	ash2+
164	ND3	Ammonia-d3	nd3
165	NH3-	Ammonia anion	nh3-
166	NH3+	ammonia cation	nh3+
167	PH3	Phosphine	ph3
168	PH3+	Phosphine cation	ph3+
169	AsH3	Arsine	ash3
170	AsH3+	Arsine cation	ash3+
171	SbH3	Stibine	sbh3
172	AsH4+	Arsonium	ash4+
173	NH4	Ammonium radical	nh4
174	NH4+	ammonium cation	nh4+
175	PH4	Phosphoranyl radical	ph4
176	PH4+	phosphonium cation	ph4+
177	O-	Oxygen atom anion	o-
178	S-	Sulfur atom anion	s-
179	S+	Sulfur atom cation	s+
180	Cr	Chromium atom	cr
181	Se-	Selenium atom anion	se-
182	Se+	Selenium atom cation	se+
183	Te	Tellurium atom	te
184	Te+	Tellurium atom cation	te+
185	DO	Hydroxyl-d	od
186	OH-	hydroxide anion	oh-
187	OH+	hydoxyl cation	oh+
188	DS	Mercapto-d	ds
189	HS	Mercapto radical	hs
190	HS-	mercapto anion	sh-
191	HS+	sulfur monohydride cation	sh+
192	CrH	Chromium hydride	crh
193	CrH+	Chromium hydride cation	crh+
194	HSe	Selenium monohydride	hse
195	HSe-	selenium monohydride anion	hse-
196	HSe+	selenium monohydride cation	hse+
197	TeH	Telluryl radical	teh
198	D2O	Deuterium oxide	d2o
199	H2O-	water anion	h2o-
200	H2O+	water cation	h2o+
201	HDO	Water-d1	hdo
202	D2S	Hydrogen sulfide-d2	d2s
203	H2S	Hydrogen sulfide	h2s
204	H2S-	Hydrogen sulfide anion	h2s-
205	H2S+	Hydrogen sulfide cation	h2s+
206	H2Se	Hydrogen selenide	h2se
207	H2Se+	Hydrogen selenide cation	h2se+
208	H2Te	Hydrogen Telluride	h2te
209	H3O+	hydronium cation	h3o+
210	H3S+	Sulfonium cation	h3s+
211	H3Se+	Hydrogen Selenide, protonated	h3se+
212	F-	Fluorine atom anion	f-
213	Cl	Chlorine atom	cl
214	Cl-	Chlorine atom anion	cl-
215	Mn	Manganese atom	mn
216	Br	Bromine atom	br
217	Br-	Bromine atom anion	br-
218	Br+	Bromine atom cation	br+
219	I	Iodine atom	iodine
220	I-	Iodine atom anion	iodine-
221	I+	Iodine atom cation	iodine+
222	DF	Hydrofluoric acid-d	df
223	HF-	hydrogen fluoride anion	hf-
224	HF+	hydrogen fluoride cation	hf+
225	DCl	Hydrochloric acid-d	dcl
226	HCl-	hydrogen chloride anion	hcl-
227	HCl+	hydrogen chloride cation	hcl+
228	HBr	hydrogen bromide	hbr
229	HBr-	hydrogen bromide anion	hbr-
230	HBr+	hydrogen bromide cation	hbr+
231	HI	Hydrogen iodide	hi
232	HI+	Hydrogen iodide cation	hi+
233	H2F+	dihydrogen fluoride cation	h2f+
234	H2Cl+	dihydrogen monochloride cation	h2cl+
235	H2Br+	protonated hydrogen bromide	h2br+
236	H2I+	Iodonium	h2i+
237	Ne	Neon atom	ne
238	Ne-	Neon atom anion	ne-
239	Ne+	Neon atom cation	ne+
240	Ar	Argon atom	ar
241	Ar-	Argon atom anion	ar-
242	Ar+	Argon atom cation	ar+
243	Fe	Iron atom	fe
244	Kr	Krypton atom	kr
245	Kr+	Krypton cation	kr+
246	Xe	Xenon atom	xe
247	HeLi+	Helium Lithium cation	heli+
248	NeH	neon hydrogen	neh
249	NeH+	neon hydrogen cation	neh+
250	ArH+	Argon hydride cation	arh+
251	KrH+	Protonated Krypton	krh+
252	XeH+	Xenon, protonated	xeh+
253	H2Ar	H2 Ar dimer	h2ar
254	Co	Cobalt atom	cobalt
255	Ni	Nickel atom	ni
256	Li2	Lithium diatomic	li2
257	Li2-	lithium diatomic anion	li2-
258	Li2+	lithium diatomic cation	li2+
259	NaLi	lithium sodium	lina
260	NaLi-	lithium sodium anion	lina-
261	NaLi+	lithium sodium cation	lina+
262	LiK	Lithium Potassium	lik
263	Na2-	sodium diatomic anion	na2-
264	Na2+	sodium diatomic cation	na2+
265	NaK	Sodium Potassium	nak
266	NaK+	Sodium Potassium diatomic cation	nak+
267	K2	Potassium diatomic	k2
268	Cu2	Copper diatomic	cu2
269	LiBe	Lithium Beryllium	libe
270	LiMg	Lithium magnesium	limg
271	NaBe	Sodium Beryllium	nabe
272	NaMg	Sodium Magnesium	namg
273	Be2	Beryllium diatomic	be2
274	Be2-	Beryllium diatomic anion	be2-
275	Be2+	Beryllium diatomic cation	be2+
276	BeMg	Beryllium Magnesium	bemg
277	Mg2	Magnesium diatomic	mg2
278	Mg2-	magnesium diatomic anion	mg2-
279	Mg2+	magnesium diatomic cation	mg2+
280	Ca2	Calcium diatomic	ca2
281	LiB	Lithium boride	lib
282	LiAl	Lithium Aluminum	lial
283	NaAl	Sodium aluminum	naal
284	BeB	Beryllium monoboride	beb
285	B2	Boron diatomic	b2
286	B2-	Boron diatomic anion	b2-
287	B2+	Boron diatomic cation	b2+
288	BAl	Boron Aluminum	bal
289	Al2	Aluminum diatomic	al2
290	Al2-	aluminum diatomic anion	al2-
291	Al2+	aluminum diatomic cation	al2+
292	BGa	Boron Gallium	bga
293	AlGa	Aluminum Gallium	alga
294	Ga2	Gallium diatomic	ga2
295	HBBH	Diborane(2)	hbbh
296	LiBH4	Lithium borohydride	libh4
297	B2H4	Diborane(4) D2d	b2h4
298	HBHHBH	Diborane(4) C2V	hbhhbh
299	B2H6	Diborane	b2h6
300	B2H6+	Diborane cation	b2h6
301	Al2H6	dialane	al2h6
302	Ga2H6	digallane	ga2h6
303	LiC	Lithium Carbide	lic
304	BeC	Beryllium Carbide	bec
305	CaC	Calcium monocarbide	cac
306	BC	boron monocarbide	bc
307	BC-	boron monocarbide anion	bc-
308	BC+	boron monocarbide cation	bc+
309	AlC	Aluminum carbide	alc
310	BSi	Boron silicide	bsi
311	C2	Carbon diatomic	c2
312	C2-	carbon diatomic anion	c2-
313	C2+	carbon diatomic cation	c2+
314	SiC	silicon monocarbide	sic
315	SiC-	silicon monocarbide anion	sic-
316	SiC+	silicon monocarbide cation	sic+
317	Si2	Silicon diatomic	si2
318	Si2-	silcon diatomic anion	si2-
319	Si2+	silcon diatomic cation	si2+
320	GeC	Germanium monocarbide	gec
321	SiGe	Silicon Germanium	sige
322	Ge2	Germanium diatomic	ge2
323	C2H	Ethynyl radical	c2h
324	C2H-	Ethynyl anion	c2h-
325	C2H+	Ethynyl cation	c2h+
326	ZnCH2	Zinc methylene	znch2
327	C2H2+	acetylene cation	c2h2+
328	CCH2	vinylidene	vinylidene
329	H2CC-	vinylidene anion	h2cc-
330	HCCH-	acetylene anion	c2h2-
331	Si2H2	disilyne	si2h2
332	CH3Li	methyl lithium	ch3li
333	CuCH3	monomethyl copper	cuch3
334	ZnCH3	Zinc monomethyl	znch3
335	CH2BH	methyleneborane	ch2bh
336	C2H3	vinyl	c2h3
337	C2H3-	vinyl anion	c2h3-
338	C2H3+	vinyl cation	c2h3+
339	C2H4-	Ethylene anion	c2h4-
340	C2H4+	Ethylene cation	c2h4+
341	CH3CH	methylmethylene	ch3ch
342	CH2SiH2	silaethylene	ch2sih2
343	Si2H4	Disilene	si2h4
344	CH3BH2	methylborane	ch3bh2
345	C2H5	Ethyl radical	c2h5
346	C2H5-	Ethyl anion	c2h5-
347	C2H5+	Ethyl cation	c2h5+
348	C2H6+	ethane cation	c2h6+
349	CH3SiH3	methyl silane	ch3sih3
350	Si2H6	disilane	si2h6
351	GeH3CH3	methyl germane	geh3ch3
352	C2H7+	Ethane, protonated	c2h7+
353	LiN	Lithium Nitride	lin
354	LiN+	Lithium Nitride cation	lin+
355	LiP	Lithium monophosphide	lip
356	BeN	Beryllium mononitride	ben
357	BeN-	Beryllium mononitride anion	ben-
358	BeN+	Beryllium mononitride cation	ben+
359	MgN	Magnesium Nitride	mgn
360	BN-	boron nitride anion	bn-
361	AlN-	aluminum mononitride anion	aln-
362	AlN+	aluminum mononitride cation	aln+
363	BP	Boron monophosphide	bp
364	AlP	Aluminum monophosphide	alp
365	GaN	Gallium mononitride	gan
366	GaP	Gallium monophosphide	gap
367	GaAs	Gallium arsenide	gaas
368	BN+	boron nitride cation	bn+
369	CN	Cyano radical	cn
370	CN-	cyanide anion	cn-
371	CN+	Cyano cation	cn+
372	CP	Carbon monophosphide	cp
373	CP-	carbon monophosphide anion	cp-
374	CP+	carbon monophosphide cation	cp+
375	SiN	Silicon nitride	sin
376	SiN-	silicon mononitride anion	sin-
377	SiN+	silicon mononitride cation	sin+
378	SiP	Silicon monophosphide	sip
379	SiP-	Silicon monophosphide anion	sip-
380	SiP+	Silicon monophosphide cation	sip+
381	TiN	Titanium mononitride	tin
382	N2-	nitrogen diatomic anion	n2-
383	N2+	diatomic nitrogen cation	n2+
384	PN	Phosphorus mononitride	pn
385	PN-	phosphorus nitride anion	pn-
386	PN+	phosphorus nitride cation	pn+
387	P2	Phosphorus diatomic	p2
388	P2-	phosphorus diatomic anion	p2-
389	P2+	phosphorus diatomic cation	p2+
390	AsN	Arsenic mononitride	asn
391	AsP	Arsenic monophosphide	asp
392	SbN	Antimony nitride	sbn
393	As2	Arsenic diatomic	as2
394	HNB	hydrogen nitrogen boron	hnb
395	HNC	hydrogen isocyanide	hnc
396	HCN	Hydrogen cyanide	hcn
397	HCN-	Hydrogen cyanide anion	hcn-
398	HCN+	hydrogen cyanide cation	hcn+
399	HNC+	hydrogen isocyanide cation	hnc+
400	HCP	Phosphaethyne	hcp
401	HCP+	Phosphaethyne cation	hcp+
402	NNH	Dinitrogen monohydride	nnh
403	NNH+	Dinitrogen monohydride cation	nnh+
404	HPO	Hydrogen phosphorus oxide	hpo
405	HPO+	Hydrogen phosphorus oxide cation	hpo+
406	LiNH2	lithium amide	linh2
407	HBNH	Boranimine	hbnh
408	CNH2	Aminomethylidyne radical	cnh2
409	CNH2+	N-protonated hydrogen isocyanide	cnh2+
410	H2CN	Dihydrogen cyanide radical	h2cn
411	H2CN+	hydrocyanonium cation	h2cn+
412	HCNH	methyleneazane	hcnh
413	HCNH+	N-protonated HCN	hcnh+
414	H2NN	Isodiazene	h2nn
415	N2H2	(Z)-Diazene	n2h2z
416	N2H2+	trans-diazene cation	n2h2+
417	CH2NH	Methanimine	ch3n
418	CH2NH+	Methanimine cation	ch2nh+
419	CHNH2	aminomethylene	chnh2
420	CHNH2+	Aminocarbene cation	chnh2+
421	BH2NH2	Boranamine	bh2nh2
422	CH2NH2+	methyleneamine cation	ch2nh2+
423	N2H4	Hydrazine	n2h4
424	N2H4+	hydrazine cation	n2h4+
425	P2H4	Diphosphine	p2h4
426	CH3NH2	methyl amine	ch3nh2
427	CH3NH2+	methyl amine cation	ch3nh2+
428	CH3PH2	Methyl phosphine	ch3ph2
429	SiH3NH2	Silane, amino	sih3nh2
430	N2H5+	protonated hydrazine	n2h5+
431	BH3PH3	borane phosphine	bh3ph3
432	BH3NH3	borane ammonia	bh3nh3
433	CH3NH3	methyl ammonium radical	ch3nh3
434	CH3NH3+	protonated methylamine	ch3nh3+
435	CH3PH3+	methyl phosphine, protonated	ch3ph3+
436	NH3NH3	Ammonia Dimer	nh3nh3
437	N2H7+	ammonia ammonium dimer	n2h7+
438	LiO	lithium oxide	lio
439	LiO-	lithium oxide anion	lio-
440	LiO+	lithium oxide cation	lio+
441	LiS	Lithium monosulfide	lis
442	LiS+	Lithium sulfide cation	lis+
443	NaO	sodium monoxide	nao
444	NaO-	sodium oxide anion	nao-
445	NaO+	sodium oxide cation	nao+
446	KO	Potassium monoxide	ko
447	KO+	Potassium monoxide cation	ko+
448	NaS	Sodium sulfide	nas
449	CuO	Copper Monoxide	cuo
450	LiSe	Lithium monoselenide	lise
451	BeO	beryllium oxide	beo
452	BeO-	Beryllium monoxide anion	beo-
453	BeO+	Beryllium monoxide cation	beo+
454	BeS	beryllium sulfide	bes
455	MgO	magnesium oxide	mgo
456	MgO-	magnesium oxide anion	mgo-
457	MgO+	magnesium oxide cation	mgo+
458	MgS	magnesium sulfide	mgs
459	MgS-	magnesium sulfide anion	mgs-
460	MgS+	magnesium sulfide cation	mgs+
461	CaS	Calcium sulfide	cas
462	ZnO	zinc monoxide	zno
463	ZnS	Zinc sulfide	zns
464	BeS-	Beryllium monosulfide anion	bes-
465	BeS+	Beryllium monosulfide cation	bes+
466	BO	boron monoxide	bo
467	AlO	Aluminum monoxide	alo
468	AlO-	Aluminum monoxide anion	alo-
469	AlO+	aluminum monoxide cation	alo+
470	BS	boron sulfide	bs
471	BS-	boron monosulfide anion	bs-
472	BS+	boron monosulfide cation	bs+
473	AlS	Aluminum sulfide	als
474	AlS-	aluminum monosulfide anion	als-
475	AlS+	aluminum monosulfide cation	als+
476	ScO	Scandium monoxide	sco
477	GaO	Gallium monoxide	gao
478	GaS	Gallium monosulfide	gas
479	BO+	boron monoxide cation	bo+
480	CO-	carbon monoxide anion	co-
481	CO+	carbon monoxide cation	co+
482	CS	carbon monosulfide	cs
483	CS-	carbon monosulfide anion	cs-
484	CS+	carbon monosulfide cation	cs+
485	SiO	Silicon monoxide	sio
486	SiO-	silicon monoxide anion	sio-
487	SiO+	silicon monoxide cation	sio+
488	SiS	silicon monosulfide	sis
489	SiS-	silicon monosulfide anion	sis-
490	SiS+	silicon monosulfide cation	sis+
491	TiO	Titanium monoxide	tio
492	CSe-	Carbon monoselenide anion	cse-
493	CSe+	Carbon monoselenide cation	cse+
494	GeO	Germanium monoxide	geo
495	GeO+	Germanium monoxide cation	geo+
496	GeS	Germanium monosulfide	ges
497	SiSe	Silicon Monoselenide	sise
498	SiSe+	Silicon Monoselenide cation	sise+
499	GeSe	Germanium monoselenide	gese
500	NO-	nitric oxide anion	no-
501	NO+	nitric oxide cation	no+
502	NS	Mononitrogen monosulfide	ns
503	NS-	nitrogen sulfide anion	ns-
504	NS+	nitrogen sulfide cation	ns+
505	PO	Phosphorus monoxide	po
506	PO-	phosphorus monoxide anion	po-
507	PO+	phosphorus monoxide cation	po+
508	PS	phosphorus sulfide	ps
509	PS-	phosphorus monosulfide anion	ps-
510	PS+	phosphorus monosulfide cation	ps+
511	VO	Vanadium monoxide	vo
512	AsO	Arsenic monoxide	aso
513	NSe	Nitrogen monoselenide	nse
514	AsS	Arsenic monosulfide	ass
515	PSe	Phosphorus monoselenide	pse
516	AsSe	Arsenic monoselenide	asse
517	O2-	oxygen diatomic anion	o2-
518	O2--	dioxygen dianion	o2--
519	O2+	diatomic oxygen cation	o2+
520	SO	Sulfur monoxide	so
521	SO-	sulfur monoxide anion	so-
522	SO+	sulfur monoxide cation	so+
523	S2	Sulfur diatomic	s2
524	S2-	sulfur diatomic anion	s2-
525	S2+	sulfur diatomic cation	s2+
526	SeO-	selenium monoxide anion	seo-
527	SeO+	selenium monoxide cation	seo+
528	SeS-	selenium monosulfide anion	ses-
529	SeS+	selenium monosulfide cation	ses+
530	TeO	Tellurium monoxide	teo
531	Se2	Selenium diatomic	se2
532	Se2-	selenium diatomic anion	se2-
533	Se2+	selenium diatomic cation	se2+
534	Te2	Tellurium diatomic	te2
535	LiOH	lithium hydroxide	lioh
536	NaOH	sodium hydroxide	naoh
537	KOH	Potassium hydroxide	koh
538	BeOH	beryllium monohydroxide	beoh
539	MgOH	magnesium hydroxide	mgoh
540	HBO	Boron hydride oxide	hbo
541	HBS	hydrogen boron sulfide	hbs
542	COH	Hydroxymethylidyne	coh
543	COH+	Carbon Monoxide, protonated	coh+
544	HCO	Formyl radical	hco
545	HCO-	formyl anion	hco-
546	HCO+	Formyl cation	hco+
547	HCS	Thioformyl radical	hcs
548	HCS-	Thioformyl anion	hcs-
549	HCS+	Thioformyl cation	hcs+
550	HNO	Nitrosyl hydride	hno
551	HNO-	Nitrosyl hydride anion	hno-
552	HNO+	Nitrosyl hydride cation	hno+
553	NOH	Hydroxyimidogen	noh
554	NOH+	O-protonated nitric oxide	noh+
555	HNS	Sulfur imide	hns
556	HNS-	Sulfur imide anion	hns-
557	HO2	Hydroperoxy radical	ho2
558	HO2-	Hydroperoxy anion	ho2-
559	HO2+	Hydroperoxy cation	ho2+
560	HSO+	Sulfur Monoxide, S-protonated	HSO+
561	SOH	Sulfur Hydroxide	soh
562	SOH+	Sulfur Monoxide, protonated	soh+
563	HS2	Thiosulfeno radical	hs2
564	H2CO-	formaldehyde anion	h2co-
565	H2CO+	formaldehyde cation	h2co+
566	HOCH	hydroxycarbene	hoch
567	H2CS	Thioformaldehyde	h2cs
568	H2CS-	thioformaldehyde anion	h2cs-
569	H2CS+	thioformaldehyde cation	h2cs+
570	H2CSe	Selenoformaldehyde	h2cse
571	H2NO	nitroxide	h2no
572	H2O2	Hydrogen peroxide	h2o2
573	H2O2+	Hydrogen peroxide cation	h2o2+
574	H2OO	water oxide	h2oo
575	HOSH	hydrogen thioperoxide	hosh
576	H2S2	Disulfane	h2s2
577	H2S2+	hydrogen disulfide cation	h2s2+
578	H2Se2	hydrogen diselenide	h2se2
579	CH2OH	Hydroxymethyl radical	ch2oh
580	CH2OH+	hydroxymethyl cation	ch2oh+
581	CH3O	Methoxy radical	ch3o
582	CH3O-	methoxy anion	ch3o-
583	CH3O+	Methoxy cation	ch3o+
584	CH3S	thiomethoxy	ch3s
585	H2CSH+	Thioformaldehyde, protonated	h2csh+
586	NH2OH	hydroxylamine	nh2oh
587	NH2OH+	Hydroxylamine cation	nh2oh+
588	NH3O	Ammonia Oxide	nh3o
589	H2POH	Phosphinous acid	h2poh
590	H3PO	Phosphine oxide	h3po
591	NH2SH	Thiohydroxylamine	nh2sh
592	NH3S	sulfidoazane	nh3s
593	H3O2+	hydrogen peroxide, protonated	h3o2+
594	CH3OH	Methyl alcohol	ch3oh
595	CH3OH-	Methyl alcohol anion	ch3oh-
596	CH3OH+	Methyl alcohol cation	ch3oh+
597	CH3SH	Methanethiol	ch3sh
598	CH3SH+	Methanethiol cation	ch3sh+
599	SiH3OH	silanol	sih3oh
600	CH3SeH	Methane selenol	ch3seh
601	NH2OH2+	protonated hydroxylamine	nh2oh2+
602	NH3OH+	N-protonated hydroxylamine	nh3oh+
603	H2OH2O	water dimer	h2oh2o
604	CH3OH2+	Methanol, protonated	ch3oh2+
605	CH3SH2+	protonated methylsulfide	ch3sh2+
606	H2ONH3	Water Ammonia Dimer	h2onh3
607	H5O2+	Dihydroxonium ion	h5o2+
608	LiF	lithium fluoride	lif
609	LiCl	lithium chloride	licl
610	LiCl-	lithium chloride anion	licl-
611	LiCl+	lithium chloride cation	licl+
612	NaF	sodium fluoride	naf
613	NaF-	sodium fluoride anion	naf-
614	NaF+	sodium fluoride cation	naf+
615	KF	Potassium Fluoride	kf
616	NaCl	Sodium Chloride	nacl
617	NaCl-	sodium chloride anion	nacl-
618	NaCl+	sodium chloride cation	nacl+
619	KCl	Potassium Chloride	kcl
620	CuF	Copper monofluoride	cuf
621	LiBr-	lithium bromide anion	libr-
622	LiBr+	lithium bromide cation	libr+
623	CuCl	Copper monochloride	cucl
624	NaBr-	sodium bromide anion	nabr-
625	NaBr+	sodium bromide cation	nabr+
626	KBr	Potassium Bromide	kbr
627	LiI	Lithium Iodide	lii
628	NaI	Sodium Iodide	nai
629	KI	Potassium Iodide	ki
630	LiF-	lithium fluoride anion	lif-
631	LiF+	lithium fluoride cation	lif+
632	BeF	Beryllium monofluoride	bef
633	BeF-	Beryllium monofluoride anion	bef-
634	BeF+	Beryllium monofluoride cation	bef+
635	BeCl	beryllium monochloride	becl
636	MgF	Magnesium monofluoride	mgf
637	MgF-	magnesium fluoride anion	mgf-
638	MgF+	magnesium fluoride cation	mgf+
639	MgCl	magnesium monochloride	mgcl
640	MgCl-	magnesium monochloride anion	mgcl-
641	MgCl+	magnesium monochloride cation	mgcl+
642	TiCl	Titanium Monochloride	ticl
643	ZnF	Zinc monofluoride	znf
644	ZnF-	Zinc monofluoride anion	znf-
645	ZnF+	Zinc monofluoride cation	znf+
646	ZnCl	Zinc monochloride	zncl
647	CaBr	Calcium monobromide	cabr
648	BeCl-	beryllium monochloride anion	becl-
649	BeCl+	beryllium monochloride cation	becl+
650	BF-	Boron monofluoride anion	bf-
651	BF+	Boron monofluoride cation	bf+
652	AlF	Aluminum monofluoride	alf
653	AlF-	Aluminum monofluoride anion	alf-
654	AlF+	Aluminum monofluoride cation	alf+
655	BCl	boron monochloride	bcl
656	BCl-	boron monochloride anion	bcl-
657	BCl+	boron monochloride cation	bcl+
658	AlCl	Aluminum monochloride	alcl
659	AlCl-	aluminum monochloride anion	alcl-
660	AlCl+	aluminum monochloride cation	alcl+
661	ScF	Scandium monofluoride	scf
662	BBr	Boron monobromide	bbr
663	GaF	Gallium monofluoride	gaf
664	GaF+	Gallium monofluoride cation	gaf+
665	AlBr	Aluminum monobromide	albr
666	GaCl	Gallium monochloride	gacl
667	GaCl+	Gallium monochloride cation	gacl+
668	AlI	Aluminum monoiodide	ali
669	GaBr	Gallium monobromide	gabr
670	CF	Fluoromethylidyne	cf
671	CF+	carbon monofluoride cation	cf+
672	CCl	carbon monochloride	ccl
673	CCl-	carbon monochloride anion	ccl-
674	CCl+	carbon monochloride cation	ccl+
675	SiF	silicon monofluoride	sif
676	SiF-	silicon monofluoride anion	sif-
677	SiF+	silicon monofluoride cation	sif+
678	SiCl	Clorosilylidyne	sicl
679	SiCl-	silicon monochloride anion	sicl-
680	SiCl+	silicon monochloride cation	sicl+
681	CBr	Carbon monobromide	cbr
682	GeF	Germanium monofluoride	gef
683	GeF+	Germanium monofluoride cation	gef+
684	GeCl	Germanium monochloride	gecl
685	GeCl+	Germanium monochloride cation	gecl+
686	SiBr	Silicon monobromide	sibr
687	SiBr+	Silicon monobromide cation	sibr+
688	NF	nitrogen fluoride	nf
689	NF-	nitrogen monofluorine anion	nf-
690	NF+	nitrogen monofluoirde cation	nf+
691	NCl	nitrogen monochloride	ncl
692	NCl-	nitrogen monochloride anion	ncl-
693	NCl+	nitrogen monochloride cation	ncl+
694	PF	phosphorus monofluoride	pf
695	PF-	phosphorus monofluoride anion	pf-
696	PF+	phosphorus monofluoride cation	pf+
697	PCl	phosphorus chloride	pcl
698	PCl-	phosphorus monochloride anion	pcl-
699	PCl+	phosphorus monochloride cation	pcl+
700	AsF	Arsenic monofluoride	asf
701	NBr	nitrogen monobromide	nbr
702	AsCl	Arsenic monochloride	ascl
703	PBr	Phosphorus monobromide	pbr
704	SbF	Antimony monofluoride	sbf
705	SbCl	Antimony monochloride	sbcl
706	FO	Oxygen monofluoride	fo
707	FO-	flourine oxide anion	fo-
708	FO+	fluorine monoxide cation	fo+
709	ClO	Monochlorine monoxide	clo
710	ClO-	chlorine monoxide anion	clo-
711	ClO+	chlorine monoxide cation	clo+
712	SF	Monosulfur monofluoride	sf
713	SF-	sulfur monofluoride anion	sf-
714	SF+	sulfur monofluoride cation	sf+
715	SCl	sulfur monochloride	scl
716	SCl-	sulfur monochloride anion	scl-
717	SCl+	sulfur monochloride cation	scl+
718	BrO	Bromine monoxide	bro
719	BrO-	Bromine monoxide anion	bro-
720	BrO+	Bromine monoxide cation	bro+
721	SeF	Selenium monofluoride	sef
722	SBr	Sulfur monobromide radical	sbr
723	SBr+	Sulfur monobromide cation	sbr+
724	SeCl	Selenium monochloride	secl
725	IO	Iodine monoxide	io
726	SeBr	Selenium monobromide	sebr
727	BrCl	Bromine monochloride	brcl
728	F2-	flourine diatomic anion	f2-
729	F2+	flourine diatomic cation	f2+
730	ClF	Chlorine monofluoride	clf
731	ClF-	clorine monofluoride anion	clf-
732	ClF+	clorine monofluoride cation	clf+
733	Cl2-	chlorine diatomic anion	cl2-
734	Cl2+	chlorine diatomic cation	cl2+
735	BrF	Bromine monofluoride	brf
736	BrF-	bromine fluoride anion	brf-
737	BrF+	bromine fluoride cation	brf+
738	BrCl-	bromine chloride anion	brcl-
739	BrCl+	bromine chloride cation	brcl+
740	IF	Iodine monofluoride	if
741	Br2	Bromine diatomic	br2
742	Br2-	bromine diatomic anion	br2-
743	Br2+	bromine diatomic cation	br2+
744	ICl	Iodine monochloride	icl
745	IBr	Iodine monobromide	ibr
746	I2	Iodine diatomic	i2
747	I2+	Iodine diatomic cation	i2+
748	HCF	Fluoromethylene	hcf
749	HCCl	Chloromethylene	hccl
750	HSiF	fluorosilylene	hsif
751	HSiCl	Chlorosilylene	hsicl
752	HSiBr	monobromosilylene	hsibr
753	CHBr	bromomethylene	chbr
754	HOF	Hypofluorous acid	hfo
755	DOCl	Hypochlorous acid-d	docl
756	HOCl	hypochlorous acid	hocl
757	HOCl+	hypochlorous acid cation	hocl+
758	HOBr+	Hypobromous acid cation	hobr+
759	HOI	Hypoiodous acid	hoi
760	F2H+	Fluorine, protonated	f2h+
761	FHF	Hydrogen difluoride	fhf
762	FHF-	Hydrogen difluoride anion	fhf-
763	ClFH+	Chlorine fluoride, F-protonated	clfh+
764	FClH+	Chlorine fluoride, Cl-protonated	fclh+
765	Cl2H+	Chlorine, protonated	cl2h+
766	CH2Br	bromomethyl radical	ch2br
767	CH2F	fluoromethyl radical	ch2f
768	CH2F+	fluoromethyl cation	ch2f+
769	CH2Cl+	chloromethyl cation	ch2cl+
770	CH2Cl	chloromethyl radical	ch2cl
771	NH2F	monofluoroamine	nh2f
772	NH2Cl	chloramine	nh2cl
773	H2F2	Hydrogen fluoride dimer	h2f2
774	CH3F+	methyl fluoride cation	ch3f+
775	CD3F	methylfluoride-d3	cd3f
776	CH3F	Methyl fluoride	ch3f
777	CD3Cl	methyl chloride d3	cd3cl
778	CH3Cl	Methyl chloride	ch3cl
779	CH3Cl+	Methyl chloride cation	ch3cl+
780	SiH3F	monofluorosilane	sih3f
781	SiH3Cl	chlorosilane	sih3cl
782	CH3Br	methyl bromide	ch3br
783	GeH3F	monofluorogermane	geh3f
784	GeH3Cl	monochlorogermane	geh3cl
785	SiH3Br	bromosilane	sih3br
786	CH3I	methyl iodide	ch3i
787	SiH3I	Silyl Iodide	sih3i
788	NH3Cl+	protonated monochloroammonia	nh3cl+
789	CH3ClH+	methyl chloride, protonated	ch3clh+
790	NH4Cl	Ammonium chloride	nh4cl
791	LiNe+	Lithium Neon cation	line+
792	Ne2	Neon diatomic	ne2
793	Ne2+	Neon diatomic cation	ne2+
794	Ar2	Argon diatomic	ar2
795	Ar2+	Argon diatomic cation	ar2+
796	Li3	Lithium trimer	li3
797	Li3+	Lithium trimer cation	li3+
798	C3	carbon trimer	c3
799	C3+	carbon trimer cation	c3+
800	SiC2	Silicon dicarbide	sic2
801	C3H3	cyclopropenyl radical	cpr
802	C3H3	Propargyl radical	propargyl
803	C3H3-	Propargyl anion	c3h3-
804	C3H3+	cyclopropenyl cation	cpr+
805	C3H3+	Propargyl cation	c3h3+
806	C3H4	cyclopropene	cprop
807	CH2CCH2	allene	allene
808	CH3CCH	propyne	propyne
809	C3H5+	Allyl cation	allyl+
810	CH3CHCH	1-propenyl radical	ch3chch
811	Zn(CH3)2	dimethyl zinc	dmz
812	C3H7	n-Propyl radical	npropyl
813	C3H7+	cyclopropane, protonated	c3h7+
814	CH3CHCH3	Isopropyl radical	isopropyl
815	CH3CHCH3+	Isopropyl cation	prop2yl+
816	C3H8	Propane	propane
817	SiH2(CH3)2	dimethylsilane	dms
818	Si3H8	trisilane	si3h8
819	LiCN	lithium cyanide	licn
820	NaCN	Sodium Cyanide	nacn
821	KCN	Potassium cyanide	kcn
822	CuCN	Copper cyanide	cucn
823	ZnCN	Zinc monocyanide	zncn
824	ZnNC	Zinc isocyanide	znnc
825	AlCN	Aluminum monocyanide	alcn
826	AlNC	Aluminum isocyanide	alnc
827	CN2	3H-Diazirin-3-ylidene	cn2
828	CNN	Diazocarbene	cnn
829	NCN	Cyanoimidogen	ncn
830	N3	azide radical	n3
831	N3-	azide anion	n3-
832	N3+	azide cation	n3+
833	HCCN	cyanomethylene	hccn
834	HCNN	diazomethyl radical	hcnn
835	HN3	hydrogen azide	hn3
836	HN3+	Hydrazoic acid cation	hn3+
837	HNCNH	diiminomethane	hncnh
838	CH2N2	diazirine	ch2n2
839	HNNNH+	1,2-Triazadienium	n2h3+
840	NH2NN+	hydrazoic acid, protonated	nh2nn+
841	CH3CN	Acetonitrile	ch3cn
842	CH3CN-	acetonitrile anion	ch3cn-
843	CH3CN+	Acetonitrile cation	ch3cn+
844	CH3NC	methyl isocyanide	ch3nc
845	CHNCH2	2H-Azirine	c157164
846	CHNHCH	1H-Azirine	chnhch
847	H2CCNH	Ethenimine	ch2cnh
848	H2CNCH	methyleneaminomethylene	ch2nch
849	HCCNH2	Ethynamine	hccnh2
850	HCNCH2+	2H-Azirine cation	hcnch2+
851	HNCNH2+	diiminomethane, protonated	hncnh2+
852	NCNH3+	Cyanamide, protonated	ncnh3+
853	NH2CNH+	cyanamide, cn protonated	nh2cnh+
854	NH3CN+	cyanamide, amine protonated	nh3cn+
855	CH2CHNH	vinylazine	ch2chnh
856	CH3CHN	methylmethaniminyl radical	ch3chn
857	C2H5N	Aziridine	c2h5n
858	CH2CHNH2	aminoethene	aminoethene
859	CH2NCH3	N-methylmethanimine	nmm
860	CH3CHNH	ethanimine	ethanimine
861	NH2BHNH2	diaminoborane	nh2bhnh2
862	C2H5NH+	Protonated Aziridine	c2h5nh+
863	C2H6N+	aziridine, protonated	c2h6n+
864	NH2CH2NH2	diaminomethane	nh2ch2nh2
865	CH3CH2NH2	Ethylamine	etam
866	CH3NHCH3	Dimethylamine	ch3nhch3
867	CH3PHCH3	dimethylphosphine	ch3phch3
868	NH2CH2NH3+	diaminoethane, protonated	pdam
869	(CH3)2NH2+	dimethylammonium cation	dmam
870	CH3CH2NH3+	ethylamine, protonated	pea
871	Li2O+	dilithium oxide cation	li2o+
872	Li2S	dilithium sulfide	li2s
873	Na2O	disodium monoxide	na2o
874	Na2S	Sodium sulfide	na2s
875	LiO2	Lithium dioxide	lio2
876	NaO2	Sodium superoxide	nao2
877	CCO	Dicarbon monoxide	cco
878	CNO-	fulminate	cno-
879	NCO	isocyanato radical	nco
880	NCO-	cyanate	nco-
881	SCN	thiocyanato radical	scn
882	SCN-	thiocyanide anion	scn-
883	BO2	Boron dioxide	bo2
884	BO2-	Boron dioxide anion	bo2-
885	BO2+	Boron dioxide cation	bo2+
886	N2O	Nitrous oxide	n2o
887	N2O-	Nitrous oxide anion	n2o-
888	N2O+	Nitrous oxide cation	n2o+
889	NNS	Nitrogen sulfide	nns
890	PPO	Phosphorus oxide phosphide	ppo
891	CO2-	Carbon dioxide anion	co2-
892	CO2+	Carbon dioxide cation	co2+
893	OCS	Carbonyl sulfide	cos
894	OCS+	Carbonyl sulfide cation	cos+
895	SiO2	silicon dioxide	sio2
896	CS2	Carbon disulfide	cs2
897	CS2-	Carbon disulfide anion	cs2-
898	CS2+	Carbon disulfide cation	cs2+
899	TiO2	Titanium dioxide	tio2
900	SiS2	Silicon disulfide	sis2
901	GeO2	Germanium dioxide	geo2
902	OCSe	Carbonyl selenide	ocse
903	SCSe	Carbon sulfide selenide	scse
904	GeS2	Germanium disulfide	ges2
905	CSe2	Carbon diselenide	cse2
906	SCTe	Carbon sulfide Telluride	scte
907	NO2	Nitrogen dioxide	no2
908	NO2-	Nitrogen dioxide anion	no2-
909	NO2+	Nitrogen dioxide cation	no2+
910	NSO	sulfinyl amidogen	NSO
911	PO2	Phosphorus dioxide	po2
912	PO2-	Phosphorus dioxide anion	po2-
913	PO2+	Phosphorus dioxide cation	po2+
914	SNO	Nitrogen oxide sulfide	sno
915	AsO2	Aresenic dioxide	aso2
916	O3	Ozone	o3
917	O3-	Ozone anion	o3-
918	O3+	Ozone cation	o3+
919	SO2-	Sulfur dioxide anion	so2-
920	SO2+	Sulfur dioxide cation	so2+
921	SSO	Disulfur monoxide	sso
922	S3	Sulfur trimer	s3
923	S3-	Sulfur trimer anion	s3-
924	S3+	Sulfur trimer cation	s3+
925	SeO2	Selenium dioxide	seo2
926	SeO2+	Selenium dioxide cation	seo2+
927	TeO2	Tellurium Dioxide	teo2
928	HCCO	ketenyl radical	ketenyl
929	CS2H+	Carbon disulfide, protonated	cs2h+
930	HCNO	fulminic acid	hcno
931	HNCO	Isocyanic acid	hnco
932	HOCN	cyanic acid	hocn
933	HNCS	Isothiocyanic acid	hncs
934	HSCN	thiocyanic acid	hscn
935	HCO2-	formate anion	hco2-
936	HNNO	nitrosoazane	hnno
937	HNNO+	Nitrous oxide, N-protonated	hnno+
938	NNOH+	Nitrous Oxide, O-protonated	nnoh+
939	HCOO	formate neutral radical	hcoo
940	HOCO	Hydrocarboxyl radical	hoco
941	HOCO+	Hydrocarboxyl cation	hoco+
942	HNO2	Nitrous acid	hno2
943	HNO2+	nitrous acid cation	hno2+
944	O3H+	protonated ozone	o3h+
945	SO2H+	protonated sulfur dioxide	so2h+
946	CH2CO	Ketene	ch2co
947	CH2CO+	Ketene cation	ch2co+
948	CH2CS	Thioketene	ch2cs
949	Be(OH)2	Beryllium hydroxide	beo2h2
950	Mg(OH)2	Magnesium dihydroxide	h2mgo2
951	NH2NO	Nitrosamide	nh2no
952	CH2O2	Dioxirane	diox
953	H2COO	Dioxymethyl radical	h2coo
954	H2COO+	dioxymethyl cation	h2coo+
955	HCOOH	Formic acid	ch2o2
956	H2O3	Hydrogen trioxide	h2o3
957	HSSSH	trisulfane	hsssh
958	NaOCH3	Sodium methoxide	naoch3
959	CH2BOH	hydroxy(methylene)borane	ch2boh
960	BH3CO	Borane carbonyl	bh3co
961	CH3BO	Borane, methyloxo-	ch3bo
962	CH2CHO	Vinyloxy radical	ch2cho
963	CH2COH+	ketene, protonated	ch2coh+
964	CH3CO	Acetyl radical	ch3co
965	CH3CO-	Acetyl anion	ch3co-
966	CH3CO+	acetyl cation	ch3co+
967	CH2NOH	formaldoxime	ch2noh
968	CH3NO	nitrosomethane	ch3no
969	CHONH2	formamide	formamide
970	CNOH3	1,2-oxaziridine	cnoh3
971	HOCHNH	hydroxymethylimine	hochnh
972	CHSNH2	thioformamide	chsnh2
973	NHCHSH	Methanimidothioic acid	nhchsh
974	CH2OOH	CH2OOH radical	ch2ooh
975	CH3OO	methylperoxy radical	ch3oo
976	CH3OO-	methylperoxy anion	ch3oo-
977	CH3OO+	methylperoxy cation	ch3oo+
978	C2H4O	Ethylene oxide	c2h4o
979	C2H4O+	ethylene oxide cation	c2h4o+
980	CH2CHOH	ethenol	ch2choh
981	CH3CHO	Acetaldehyde	ch3cho
982	CH3CHO+	acetaldehyde cation	ch3cho+
983	H2COCH2+	Methyl, (methyleneoxoniumyl)-	h2coch2+
984	C2H4S	Thiirane	thiirane
985	CH2CHSH	Ethenethiol	ch2chsh
986	CH3CHS	Thioacetaldehyde	ch3chs
987	H2CONH2+	protonated formamide	h2conh2+
988	NH2CHOH+	Formamide, O-protonated	nh2choh+
989	NH3CHO+	Formamide, N-Protonated	nh3cho+
990	CH2(OH)2	methanediol	ch2o2h2
991	CH3OOH	Methyl peroxide	ch3ooh
992	CH3SSH	Hydrogen methyl disulfide	ch3ssh
993	HSCH2SH	Methanedithiol	ch4s2
994	H2OH2CO	water formaldehyde dimer	h2oh2co
995	C2H4OH+	ethylene oxide, protonated	c2h4oh+
996	CH2CH2OH	2-hydroxy ethyl radical	ch2ch2oh
997	CH3CH2O	Ethoxy radical	ethoxy
998	CH3CHOH	1-hydroxy-ethyl radical	ch3choh
999	CH3CHOH+	acetaldehyde, protonated	ch3choh+
1000	CH3OCH2	methoxymethyl radical	ch3och2
1001	NH2CH2OH	aminomethanol	nh2ch2oh
1002	CH3CH2OH	Ethanol	etoh
1003	CH3OCH3	Dimethyl ether	meome
1004	CH3CH2SH	ethanethiol	etsh
1005	CH3SCH3	Dimethyl sulfide	mesme
1006	CH3SCH3+	dimethyl sulfide cation	mesme+
1007	CH3SeCH3	dimethylselenide	dmse
1008	CH3OHH2O	methanol water dimer	ch3ohh2o
1009	H2OCH3OH	water methanol dimer	h2och3oh
1010	CuF2	Copper difluoride	cuf2
1011	ZnF2	Zinc difluoride	znf2
1012	CNF	iso cyanogen fluoride	cnf
1013	ClCN	chlorocyanogen	clcn
1014	BrCN	Cyanogen bromide	brcn
1015	ICN	Cyanogen iodide	icn
1016	FBO	Boron monofluoride monoxide	fbo
1017	BeF2	Beryllium fluoride	bef2
1018	MgF2	Magnesium fluoride	mgf2
1019	BeCl2	Beryllium chloride	becl2
1020	MgCl2	Magnesium dichloride	mgcl2
1021	CaCl2	Calcium Chloride	cacl2
1022	ZnCl2	Zinc dichloride	zncl2
1023	BeBr2	Beryllium bromide	bebr2
1024	CaBr2	Calcium dibromide	cabr2
1025	CaF2	Calcium difluoride	caf2
1026	FCO	Carbonyl fluoride	fco
1027	FCO+	Carbonyl fluoride cation	fco+
1028	ClCO	carbonyl monochloride	clco
1029	BF2	Boron difluoride radical	bf2
1030	FNO	Nitrosyl fluoride	fno
1031	ClNO	Nitrosyl chloride	clno
1032	FNS	Thionitrosyl fluoride	fns
1033	FSN	Thiazyl fluoride	fsn
1034	OPCl	Phosphorus oxychloride	opcl
1035	BrNO	Nitrosyl bromide	brno
1036	INO	Nitrosyl iodide	ino
1037	CF2	Difluoromethylene	cf2
1038	CF2-	Difluoromethylene anion	cf2-
1039	CF2+	Difluoromethylene cation	cf2+
1040	CFCl	chlorofluoromethylene	cfcl
1041	SiF2	Silicon difluoride	sif2
1042	SiF2+	Silicon difluoride cation	sif2+
1043	CCl2	dichloromethylene	ccl2
1044	CCl2-	dichloromethylene anion	ccl2-
1045	CCl2+	dichloromethylene cation	ccl2+
1046	SiCl2	Dichlorosilylene	sicl2
1047	GeF2	Germanium difluoride	gef2
1048	GeCl2	Germanium dichloride	gecl2
1049	CBr2	dibromomethylene	cbr2
1050	FOO	Dioxygen monofluoride radical	foo
1051	FOO+	Fluorine dioxide cation	foo+
1052	ClOO	chloroperoxy radical	cloo
1053	ClOO+	chloroperoxy cation	cloo+
1054	OClO	Chlorine dioxide	oclo
1055	OClO-	Chlorine dioxide anion	oclo-
1056	OClO+	Chlorine dioxide cation	oclo+
1057	ClSO	Sulfur chloride oxide	clso
1058	ClS2	Sulfur chloride	cls2
1059	BrOO	Bromine dioxide	broo
1060	OBrO	Bromine dioxide radical	obro
1061	NF2	Difluoroamino radical	nf2
1062	NF2+	Difluoroamino cation	nf2+
1063	PF2	Phosphorus difluoride	pf2
1064	PF2+	Phosphorus difluoride cation	pf2+
1065	FClO	chlorosyl fluoride	fclo
1066	F2O	Difluorine monoxide	f2o
1067	ClOF	Chlorine hypofluorite	clof
1068	SF2	sulfur difluoride	sf2
1069	SF2-	sulfur difluoride anion	sf2-
1070	SF2+	sulfur difluoride cation	sf2+
1071	Cl2O	Dichlorine monoxide	cl2o
1072	SCl2	Sulfur dichloride	scl2
1073	SeF2	Selenium difluoride	sef2
1074	BrOCl	Bromine hypochlorite	brocl
1075	SeCl2	Selenium Dichloride	secl2
1076	SBr2	Sulfur dibromide	sbr2
1077	SeBr2	Selenium dibromide	sebr2
1078	BrOBr	Bromine oxide	brobr
1079	F3-	trifluoride anion	f3-
1080	Cl3-	trichloride anion	cl3-
1081	Br3-	tribromide anion	br3-
1082	I3-	triiodide	i3-
1083	SFCl	Sulfur chloride fluoride	sfcl
1084	HCCF+	fluoroacetylene cation	hccf+
1085	HCCCl	Chloroacetylene	hcccl
1086	HCCBr	bromoacetylene	hccbr
1087	HFCO	formyl fluoride	hfco
1088	HFCO+	formyl fluoride cation	hfco+
1089	COHCl	Formyl chloride	cohcl
1090	COHBr	Formyl bromide	cohbr
1091	BHF2	Difluoroborane	bhf2
1092	BHCl2	Borane, dichloro-	bhcl2
1093	CHCl2	dichloromethyl radical	chcl2
1094	CHF2	difluoromethyl radical	chf2
1095	CHF2+	difluoromethyl cation	chf2+
1096	CHFCl	Chlorofluoromethyl radical	chfcl
1097	CHFCl+	Chlorofluoromethyl cation	chfcl+
1098	CHCl2+	dichloromethyl cation	chcl2+
1099	CHBr2	dibromomethyl radical	chbr2
1100	HOClO	Chlorous acid	hoclo
1101	NHF2	difluoramine	nhf2
1102	NHCl2	dichloroamine	nhcl2
1103	CH2F2	Methane, difluoro-	ch2f2
1104	CH2FCl	fluorochloromethane	ch2fcl
1105	SiH2F2	difluorosilane	sih2f2
1106	CH2Cl2	Methylene chloride	ch2cl2
1107	CH2BrF	Methane, bromofluoro-	ch2fbr
1108	CH2BrCl	Methane, bromochloro-	ch2clbr
1109	CH2FI	fluoroiodomethane	ch2fi
1110	CH2Br2	dibromomethane	ch2br2
1111	CH2ClI	chloroiodomethane	ch2cli
1112	CH2BrI	bromoiodomethane	ch2bri
1113	CH2I2	Diiodomethane	ch2i2
1114	SiH2Cl2	dichlorosilane	sih2cl2
1115	CH3MgBr	Methyl Magnesium Bromide	ch3mgbr
1116	CH2CHF	Ethene, fluoro-	ch2chf
1117	CH2CHF+	fluoroethene cation	ch2chf+
1118	C2H3Cl	Ethene, chloro-	ch2chcl
1119	C2H3I	Vinyl iodide	c2h3i
1120	CH2FOH	fluoromethanol	ch2foh
1121	CH3OCl	methyl hypochlorite	ch3ocl
1122	CH2CH2Cl	2-chloroethyl radical	ch2ch2cl
1123	CHClCH3	1-chloroethyl radical	chclch3
1124	CH3CH2Cl	Ethyl chloride	c2h5cl
1125	CH3SiFH2	fluoromethylsilane	ch3sifh2
1126	C2H5I	Ethyl iodide	c2h5i
1127	KrF2	Krypton difluoride	krf2
1128	XeF2	Xenon difluoride	xef2
1129	B4H10	Tetraborane(10)	b4h10
1130	C4+	Carbon tetramer cation	c4+
1131	C4H2	Diacetylene	c4h2
1132	C4H2+	diacetlyene cation	c4h2+
1133	C2H3CCH	1-Buten-3-yne	c2h3cch
1134	C4H4	cyclobutadiene	cbd
1135	C4H4	Tetrahedrane	c4h4
1136	H2CCCCH2	Butatriene	h2cccch2
1137	C4H6	1-Methylcyclopropene	c3100047
1138	C4H6	Cyclobutene	c822355
1139	C4H6	Methylenecyclopropane	c6142730
1140	CH2CCHCH3	1,2-Butadiene	butad12
1141	CH2CHCHCH2	1,3-Butadiene	c106990
1142	CH3CCCH3	2-Butyne	c503173
1143	CHCCH2CH3	1-Butyne	c107006
1144	CH3CHCHCH2	methylallyl radical	c4h7
1145	C4H8	methylcyclopropane	mcp
1146	CH2C(CH3)CH3	1-Propene, 2-methyl-	isobute
1147	CH2CHCH2CH3	1-Butene	bute1
1148	CH3CHCHCH3	2-Butene, (E)-	bute2e
1149	CH3CHCHCH3	2-Butene, (Z)-	bute2z
1150	B(CH3)3	trimethylborane	bme3
1151	Al(CH3)3	trimethyl aluminum	tma
1152	C(CH3)3	Tert-butyl radical	tbutyl
1153	CH2CH(CH3)2	Isobutyl radical	isobutyl
1154	CH3CHCH2CH3	2-Butyl radical	butyl2
1155	CH3CH(CH3)CH3	Isobutane	isobutane
1156	CH3CH2CH2CH3	Butane	butane
1157	SiH(CH3)3	trimethylsilane	trimsi
1158	Li3N	trilithium nitride	li3n
1159	C2N2	Cyanogen	c2n2
1160	C2N2+	Cyanogen cation	c2n2+
1161	P4	Phosphorus tetramer	p4
1162	As4	Arsenic tetramer	as4
1163	HCCCN	Cyanoacetylene	hcccn
1164	HCCCN+	Cyanoacetylene cation	hcccn+
1165	H2CNCN	cyanamide, methylene	ch2ncn
1166	HNCCNH	Ethenediimine	hnccnh
1167	C3H3N	acrylonitrile	ch2chcn
1168	C3H3N+	acrylonitrile cation	ch2chcn+
1169	CH3N3	methyl azide	ch3n3
1170	NH2CCNH2	Diaminoacetylene	daa
1171	NH2CH2CN	Aminoacetonitrile	aan
1172	CH3NHN2+	methyl azide, protonated	ch3nhn2+
1173	C2H5CN	ethyl cyanide	c2h5cn
1174	CH5N3	Guanidine	guanidine
1175	C4H6	Bicyclo[1.1.0]butane	c157335
1176	CH3NNCH3	(Z)-1,2-Dimethyldiazene	dmdiazz
1177	H2NCHCHNH2	diaminoethylene	dae
1178	CH6N3+	guanidinium	ch6n3+
1179	C3H7N	Cyclopropylamine	cpram
1180	CH7N3	triaminomethane	tam
1181	C3H7N	Azetidine	azet
1182	C4H8	cyclobutane	cbutane
1183	C2H8N2	Ethylenediamine	ethdiam
1184	CH3NHNHCH3	dimethyl hydrazine	dmh
1185	CH3CH(NH2)CH3	2-Propanamine	pram2
1186	N(CH3)3	Trimethylamine	trimeam
1187	NH2CH2CH2CH3	1-Propanamine	pram1
1188	P(CH3)3	trimethylphosphine	tmp
1189	N(SiH3)3	trisilylamine	tsa
1190	As(CH3)3	trimethyl arsine	tmas
1191	(CH3)3NH+	protonated trimethyl amine	ptma
1192	C3H7NH3+	n-propylamine, protonated	c3h7nh2
1193	Li2O2	dilithium dioxide	li2o2
1194	Na2O2	disodium dioxide	na2o2
1195	K2O2	dipotassium dioxide	k2o2
1196	C3O	Tricarbon monoxide	c3o
1197	B2O2	Diboron dioxide	b2o2
1198	ONNO	NO dimer	onno
1199	S2N2	Disulfur dinitride	s2n2
1200	CO3	Carbon trioxide	co3
1201	CO3--	carbonate	co3--
1202	CS3--	Carbonotrithioate	cs3--
1203	NO3-	nitrate anion	no3-
1204	NO3+	nitrogen trioxide cation	no3+
1205	SO3	Sulfur trioxide	so3
1206	SO3-	Sulfur trioxide anion	so3-
1207	SO3--	Sulfate dianion	so3--
1208	SO3+	Sulfur trioxide cation	so3+
1209	SeO3	selenium trioxide	seo3
1210	S4	Sulfur tetramer	s4
1211	TeO3	Tellurium trioxide	teo3
1212	HCO3-	bicarbonate anion	hco3-
1213	HNO3	Nitric acid	hno3
1214	HSO3	Hydroxysulfonyl radical	hso3
1215	NH2NO2	nitramide	nh2no2
1216	C2H2CO	cyclopropenone	c2h2co
1217	C3H2O	Propadienal	c3h2o
1218	HCCCHO	2-propynal	hcccho
1219	C2H2O2	Ethanedial	c2h2o2
1220	C2H2O2+	Ethanedial cation	c2h2o2+
1221	H2CO3	Carbonic acid	h2co3
1222	H2CS3	thiocarbonic acid	h2cs3
1223	H2NO3+	Nitric Acid, Protonated	h2no3+
1224	H2SO3	Sulfurous acid	h2so3
1225	C2H3NO	Nitrosoethylene	c2h3no
1226	CH3NCO	methylisocyante	ch3nco
1227	HOCH2CN	cyanomethanol	hoch2cn
1228	CH3COO-	acetate anion	ch3coo-
1229	CH3NO2	Methane, nitro-	ch3no2
1230	CH3ONO	Methyl nitrite	ch3ono
1231	NH2COOH	Carbamic acid	nh2cooh
1232	H3BO3	Boric acid	h3bo3
1233	H3AlO3	Aluminum hydroxide	h3alo3
1234	H3CO3+	carbonic acid, protonated	h3co3+
1235	C3H4O	2-Propyn-1-ol	c107197
1236	C3H4O	allenol	c9000071
1237	C3H4O	Cyclopropanone	cpone
1238	C3H4O	Methylketene	c6004440
1239	NH2CONH2	Urea	urea
1240	NH2CONH2+	Urea cation	urea+
1241	NH2CSNH2	Thiourea	thiourea
1242	C2H4O2	1,3-dioxetane	c2h4o2
1243	CH3COOH	Acetic acid	ch3cooh
1244	CH3OCHO	methyl formate	ch3ocho
1245	CHOCH2OH	hydroxy acetaldehyde	haa
1246	NH2COOH2+	Carbamic acid, O-protonated	nh2cooh2+
1247	NH3COOH+	protonated Carbamic acid	nh3cooh+
1248	H2OHCOOH	Water formic acid dimer 1	h2ohcooh_10
1249	H2OHCOOH	Water formic acid dimer 2	h2ohcooh_11
1250	HCOOHH2O	Formic acid water dimer	hcoohh2o
1251	HOCH2OOH	hydroxy methyl peroxide	hoch2ooh
1252	CH3COCH2	Acetonyl radical	ch3coch2
1253	CH2C(OH)NH2	1-amino vinyl alchohol	ava
1254	CH3C(OH)=NH	Ethaninidic acid	eia
1255	CH3CHNOH	Acetaldoxime	acetaldoxime
1256	CH3CONH2	Acetamide	acetamide
1257	HCONHCH3	N-methylformamide	nmfa
1258	CH3CSNH2	Ethanethioamide	ch3csnh2
1259	CH5N2O+	urea, N-protonated	ch4n2o+
1260	H2NCOHNH2+	urea, protonated	ureah+
1261	C2H5OO	ethylperoxy radical	c2h5oo
1262	CH3NNCH3	(E)-1,2-Dimethyldiazene	dmdiaze
1263	C3H5OH	Cyclopropanol	cproh
1264	C3H6O	2-Propen-1-ol	c107186
1265	C3H6O	Acetone enol	enol
1266	C3H6O	Oxetane	oxetane
1267	C3H6O	Propylene oxide	prox
1268	CH3CH2CHO	Propanal	propanal
1269	CH3COCH3	Acetone	acetone
1270	CH3COCH3-	acetone anion	ch3coch3-
1271	C3H6S	Thietane	thietane
1272	C3H6S	Thiirane, methyl-	methiirane
1273	CH3CSCH3	Thioacetone	ch3csch3
1274	C2H6O2	1,2-Ethanediol	ethdiol
1275	CH3OOCH3	dimethylperoxide	dmp
1276	CH3SOCH3	Dimethyl sulfoxide	dmso
1277	CH2SHCH2SH	1,2-Ethanedithiol	ethdisl
1278	CH3SSCH3	Disulfide, dimethyl	ch3ssch3
1279	CH3COHCH3+	acetone, protonated	acetoneh+
1280	HOCH2CH2NH2	monoethanolamine	mea
1281	C3H7OH	1-Propanol	proh
1282	CH3CHOHCH3	Isopropyl alcohol	isoproh
1283	CH3OC2H5	Ethane, methoxy-	etome
1284	C3H7SH	1-Propanethiol	prsh
1285	CH3CHSHCH3	2-Propanethiol	isoprsh
1286	CH3SCH2CH3	Ethane, (methylthio)-	etsme
1287	H2OCH3OCH3	water dimethylether dimer	h2och3och3
1288	Li2F2	Lithium fluoride dimer	li2f2
1289	Na2F2	Sodium Fluoride Dimer	na2f2
1290	Na2Cl2	Disodium dichloride	na2cl2
1291	C2Cl2	dichloroacetylene	c2cl2
1292	C2Cl2+	dichloroacetylene cation	c2cl2+
1293	FNO2	Nitryl fluoride	fno2
1294	FONO	Nitrosyl hypofluorite	fono
1295	ClNO2	Nitryl chloride	clno2
1296	ClONO	chlorine nitrite	clono
1297	BrONO	Bromine nitrite	brono
1298	N2F2	(Z)-Difluorodiazene	n2f2_z
1299	N2F2	Dinitrogen difluoride, (E)-	n2f2_e
1300	CF2O	Carbonic difluoride	f2co
1301	CF2O+	Carbonic difluoride cation	f2co+
1302	COFCl	Carbonic chloride fluoride	cofcl
1303	CCl2O	Phosgene	cl2co
1304	Cl2CS	Thiophosgene	cl2cs
1305	COBr2	Carbonic dibromide	cobr2
1306	BF3-	Borane, trifluoro- anion	bf3-
1307	BF3+	boron trifluoride cation	bf3+
1308	BClF2	Chlorodifluoroborane	bclf2
1309	AlF2Cl	Aluminum chloride difluoride	alclf2
1310	ScF3	Scandium trifluoride	ScF3
1311	AlFCl2	Aluminum dichloride fluoride	alcl2f
1312	BCl3	Borane, trichloro-	bcl3
1313	BCl3+	Boron Trichloride cation	bcl3+
1314	GaF3	Gallium trifluoride	gaf3
1315	AlCl3	Aluminum trichloride	alcl3
1316	GaCl3	Gallium trichloride	gacl3
1317	BBr3	Boron tribromide	bbr3
1318	AlBr3	Aluminum Bromide	albr3
1319	ClO3	Chlorine trioxide	clo3
1320	ClO3-	chlorate anion	clo3-
1321	BrO3-	Bromate anion	bro3-
1322	CF3	Trifluoromethyl radical	cf3
1323	CF3-	Trifluoromethyl anion	cf3-
1324	CF3+	Trifluoromethyl cation	cf3+
1325	CF2Cl	difluorochloromethyl radical	cf2cl
1326	SiF3	Silicon trifluoride radical	sif3
1327	SiF3+	Silicon trifluoride cation	sif3+
1328	CFCl2	dichlorofluoromethyl radical	cfcl2
1329	CCl3	Trichloromethyl radical	ccl3
1330	CCl3-	Trichloromethyl anion	ccl3-
1331	CCl3+	Trichloromethyl cation	ccl3+
1332	SiCl3	trichlorosilyl radical	sicl3
1333	SiCl3+	trichlorosilyl cation	sicl3+
1334	CBr3	tribromomethyl radical	cbr3
1335	FOOF	Perfluoroperoxide	foof
1336	ClO2F	Chloryl fluoride	clo2f
1337	F2SO	Thionyl Fluoride	f2so
1338	ClOOCl	Dichlorine dioxide	cloocl
1339	FSSF	Difluorodisulfane	fssf
1340	S2F2	Thio-thionyl fluoride	s2f2
1341	SOCl2	thionyl chloride	socl2
1342	SSCl2	Thiothionyl chloride	sscl2
1343	SeOCl2	selenium oxychloride	seocl2
1344	NF3	Nitrogen trifluoride	nf3
1345	NF3-	Nitrogen trifluoride anion	nf3-
1346	NF3+	Nitrogen trifluoride cation	nf3+
1347	PF3	Phosphorus trifluoride	pf3
1348	NCl3	nitrogen trichloride	ncl3
1349	AsF3	Arsenic trifluoride	asf3
1350	PCl3	Phosphorus trichloride	pcl3
1351	SbF3	Antimony Trifluoride	sbf3
1352	AsCl3	Arsenous trichloride	ascl3
1353	SbCl3	Antimony Trichloride	sbcl3
1354	NBr3	Nitrogen Tribromide	nbr3
1355	PBr3	Phosphorus tribromide	pbr3
1356	AsBr3	Arsenic tribromide	asbr3
1357	PI3	Phosphorus triiodide	pi3
1358	ClSSCl	Disulfur dichloride	s2cl2
1359	SF3	Sulfur trifluoride	sf3
1360	ClF3	Chlorine trifluoride	clf3
1361	BrF3	Bromine trifluoride	brf3
1362	IF3	iodone trifluoride	if3
1363	HClO3	Chloric Acid	hclo3
1364	CHF3	Methane, trifluoro-	chf3
1365	CHF2Cl	difluorochloromethane	chf2cl
1366	SiHF3	trifluorosilane	sihf3
1367	CHFCl2	fluorodichloromethane	chfcl2
1368	CDCl3	trichloromethane-d	cdcl3
1369	CHCl3	Chloroform	chcl3
1370	CHBrF2	Methane, bromodifluoro-	chbrf2
1371	SiHCl3	Trichlorosilane	sihcl3
1372	CHFClBr	fluorochlorobromomethane	chfclbr
1373	CHBrCl2	Methane, bromodichloro-	chbrcl2
1374	CHF2I	difluoroiodomethane	chf2i
1375	CHBr2F	dibromofluoromethane	chbr2f
1376	CHFClI	fluorochloroiodomethane	chfcli
1377	CHCl2I	dichloroiodomethane	chcl2i
1378	CHClBr2	Methane, dibromochloro-	chclbr2
1379	CHBr3	bromoform	chbr3
1380	CHI3	Iodoform	chi3
1381	NF3H+	protonated nitrogen trifluoride	nf3h+
1382	AsF3H+	Arsenic trifluoride, protonated	asf3h+
1383	C2H2F2	Ethene, 1,2-difluoro-, (E)-	c2h2f2e
1384	C2H2F2	Ethene, 1,2-difluoro-, (Z)-	c2h2f2z
1385	CH2CF2	Ethene, 1,1-difluoro-	ch2cf2
1386	C2H2ClF	1-chloro-1-fluoroethylene	c2h2clf
1387	CHFCHCl	(E)-1-chloro-2-fluoroethene	chfchcle
1388	CHFCHClz	(Z)-1-Chloro-2-fluoroethene	chfchclz
1389	CH2CCl2	Ethene, 1,1-dichloro-	ch2ccl2
1390	CHClCHCl	Ethene, 1,2-dichloro-, (E)-	chclchcle
1391	CHClCHCl	Ethene, 1,2-dichloro-, (Z)-	chclchclz
1392	C2H2Br2	1,1-dibromoethene	c2h2br2
1393	CHBrCHBr	Ethene, 1,2-dibromo-, (E)-	chbrchbre
1394	CHBrCHBr	Ethene, 1,2-dibromo-, (Z)-	chbrchbrz
1395	CH2FCHO	Fluoroacetaldehyde	ch2fcho
1396	CH3COF	Acetyl fluoride	ch3cof
1397	CH2ClCHO	chloroacetaldehyde	ch2clcho
1398	CH3COCl	Acetyl Chloride	ch3cocl
1399	C2H4F2	1,2-difluoroethane	c2h4f2
1400	CH3CHF2	Ethane, 1,1-difluoro-	ch3chf2
1401	CH2FCH2Cl	Ethane, 1-chloro-2-fluoro-	ch2fch2cl
1402	CH3CHFCl	Ethane, 1-chloro-1-fluoro-	ch3chfcl
1403	CH2ClCH2Cl	Ethane, 1,2-dichloro-	ch2clch2cl
1404	CH3CHCl2	Ethane, 1,1-dichloro-	ch3chcl2
1405	CH2BrCH2Cl	1-bromo-2-chloroethane	ch2brch2cl
1406	CH2BrCH2Br	Ethane, 1,2-dibromo-	ch2brch2br
1407	CH2CFCH3	2-fluoropropene	2fpro
1408	CH2CHCH2F	Allyl Fluoride	allylf
1409	CH3CHCHF	trans-1-Fluoro-1-propene	propene1ft
1410	C3H5Cl	1-Propene, 3-chloro-	prop1cl3
1411	C3H5Cl	1-chloro-1-propene(E)	prop1cl1e
1412	C3H5Cl	1-chloro-1-propene(Z)	prop1cl1z
1413	CH2FCH2OH	2-fluoroethanol	ch2fch2oh
1414	CH2ClCH2OH	2-Chloroethanol	ch2clch2oh
1415	CH2ClCH2OH2+	2-chloroethanol, protonated	ch2clch2oh2+
1416	CH2FCH2CH3	1-Fluoropropane	prf1
1417	CH3CHFCH3	2-Fluoropropane	prf2
1418	CH2ClCH2CH3	Propane, 1-chloro-	prcl1
1419	CH3CHClCH3	Propane, 2-chloro-	prcl2
1420	CH3CH2CH2Br	n-propyl bromide	prbr
1421	CH3CHBrCH3	i-propyl bromide	iprbr
1422	C3H9O+	trimethyl oxonium cation	c3h9o+
1423	B5H9	pentaborane9	b5h9
1424	C5H4	pentatetraene	ptrene
1425	C5H5	cyclopentadienyl radical	c5h5
1426	C5H5-	cylopentadienyl anion	c5h5-
1427	C5H6	1,3-Cyclopentadiene	c542927
1428	C5H6	1-Buten-3-yne, 2-methyl-	c78808
1429	C5H6	3-Penten-1-yne, (E)-	c2004695
1430	C5H6	3-Penten-1-yne, (Z)-	c1574409
1431	C5H6	Bicyclo[2.1.0]pent-2-ene	c5164352
1432	C5H6	Cyclopropylacetylene	c6746947
1433	C5H6	Propellane	propellane
1434	C5H7	1,3-pentadienyl radical	pdyl
1435	C5H7	cyclopentenyl radical	cpyl
1436	C5H8	1,2-Butadiene, 3-methyl-	c598254
1437	C5H8	1,2-Pentadiene	c591957
1438	C5H8	1,3-Butadiene, 2-methyl-	c78795
1439	C5H8	1,3-Pentadiene, (E)-	c2004708
1440	C5H8	1,3-Pentadiene, (Z)-	c1574410
1441	C5H8	1,4-Pentadiene	c591935
1442	C5H8	1-pentyne	a1pentyne
1443	C5H8	2,3-Pentadiene	c591968
1444	C5H8	Bicyclo[1.1.1]pentane	bcp
1445	C5H8	Cyclobutane, methylene-	c1120565
1446	C5H8	Cyclopentene	c142290
1447	C5H8	Ethenylcyclopropane	c693867
1448	CH3CCCH2CH3	2-Pentyne	2pentyne
1449	C5H10	1-Butene, 2-methyl-	c563462
1450	C5H10	2-Butene, 2-methyl-	c513359
1451	C5H10	2-Pentene, (E)-	c646048
1452	C5H10	2-Pentene, (Z)-	c627203
1453	C5H10	Cyclopentane	c287923
1454	C5H10	Cyclopropane, 1,1-dimethyl-	c1630940
1455	CH2CHCH2CH2CH3	1-pentene	pentene
1456	C5H11	2-Methylbut-2-yl radical	c4348350
1457	C5H12	Butane, 2-methyl-	buta2
1458	C5H12	Pentane	pentane
1459	C5H12	Propane, 2,2-dimethyl-	neopentane
1460	Si(CH3)4	tetramethylsilane	tms
1461	N2O3	Dinitrogen trioxide	n2o3
1462	C3H2N2	Malononitrile	c3h2n2
1463	CH2N4	1H-Tetrazole	1htz
1464	C3H3N2	imidazolyl radical	im
1465	C3H3N2-	imidizolyl anion	im-
1466	C2H3N3	1H-1,2,4-Triazole	c288880
1467	C4H4N	pyrrolide radical	c4h4n
1468	C4H4N-	pyrrolide anion	c4h4n-
1469	C3H4N2	1H-Imidazole	1himidaz
1470	C3H4N2	1H-Pyrazole	1hpyraz
1471	C3H4N2	2H-Imidazole	imid2h
1472	C3H4N2	4H-Imidazole	imid4h
1473	C4H5N	(E)-2-Butenenitrile	c627269
1474	C4H5N	(Z)-2-Butenenitrile	c1190767
1475	C4H5N	2H-pyrrole	pyrrole2
1476	C4H5N	3H-pyrrole	pyrrole3
1477	C4H5N	Cyclopropanecarbonitrile	c5500210
1478	C4H5N	Pyrrole	pyrrole
1479	CH2CHCH2CN	Allylcyanide	ch2chch2cn
1480	C4H6N+	pyrrole, alpha-protonated	appyr
1481	C4H6N+	pyrrole, beta-protonated	bppyr
1482	C4H6N+	pyrrole, protonated	ppyr
1483	C3H6N2	3-Aminopropionitrile	c151188
1484	CH3CH(CH3)CN	Propanenitrile, 2-methyl-	c4h7n
1485	CH3CH2CH2CN	Butanenitrile	c109740
1486	C5H8	Bicyclo[2.1.0]pentane	c185944
1487	C5H8	Spiropentane	c157404
1488	C4H9N	Cyclobutylamine	cbam
1489	C4H9N	Pyrrolidine	pyrrolidine
1490	C3H10N2	1,2-Diaminopropane	diampr12
1491	C(CH3)3NH2	2-Propanamine, 2-methyl-	c75649
1492	C(NH2)H2C(CH3)HCH3	1-Propanamine, 2-methyl-	c78819
1493	C(NH2)H2CH2CH2CH3	1-Butanamine	butam1
1494	CH3C(NH2)HCH2CH3	2-Butanamine	butam2
1495	NH(C2H5)2	diethylamine	dea
1496	NC4H12+	tetramethyl ammonium cation	nc4h12+
1497	C3O2	Carbon suboxide	c3o2
1498	C3O2+	Carbon suboxide cation	c3o2+
1499	B2O3	diboron trioxide	b2o3
1500	MgCO3	Magnesium Carbonate	mgco3
1501	BeCO3	Beryllium Carbonate	beco3
1502	ONONO	Nitrosyl nitrite	onono
1503	PO4---	phosphate	po4---
1504	SO4--	sulfate	so4--
1505	HOONO2	peroxy nitric acid	hoono2
1506	HSO4-	bisulfate anion	hso4-
1507	C2H2N2S	1,3,4-Thiadiazole	c2h2n2s
1508	C3H2O2	Propiolic acid	c3h2o2
1509	CHOCOOH	oxo acetic acid	oaa
1510	CHOOCHO	diformyl ether	choocho
1511	H2SO4	Sulfuric acid	h2so4
1512	H2SeO4	Selenic acid	h2seo4
1513	C3H3NO	Isoxazole	isox
1514	C3H3NO	Oxazole	oxazole
1515	C3H3NS	Thiazole	thiazole
1516	CH3C(O)OO	acetyl peroxy radical	ch3coo2
1517	CH3NO3	Methyl nitrate	ch3no3
1518	H3PO4	Phosphoric Acid	h3po4
1519	C4H4O	Furan	furan
1520	C4H4O+	Furan cation	furan+
1521	CH3COCCH	3-butyn-2-one	c1423605
1522	C4H4S	Thiophene	furans
1523	C4H4Se	selenophene	c4h4se
1524	C3H4O2	β–Propiolactone	beta
1525	C3H4O2	2-Propenoic acid	propenoic2
1526	C3H4O2	Methyl glyoxal	megly
1527	C3H4O2	propanedial	propanedial
1528	C3H4O2	propenalol	propenalol
1529	HOCHCCHOH	allenediol	aldiol
1530	C2H4O3	1,2,3-trioxolane	c2h4o3
1531	C2H4O3	trioxolane124	triox
1532	HOCH2COOH	Hydroxyacetic acid	hac
1533	CH2CHCONH2	Acrylamide	c79061
1534	CH3OCH2CN	Methoxyacetonitrile	c1738369
1535	CH5N3S	Hydrazinecarbothioamide	c79196
1536	H2NCH2COOH	Glycine	glycine
1537	CH3SO2NH2	methanesulfonamide	ch3so2nh2
1538	C4H6O	cis-2-butenal	butenal2c
1539	C4H6O	Cyclobutanone	cbutone
1540	C4H6O	Furan, 2,3-dihydro-	furan23h
1541	C4H6O	Furan, 2,5-dihydro-	furan25h
1542	CH2CHOCHCH2	Vinyl ether	vinylether
1543	CHOCHCHCH3	2-Butenal	butenal2
1544	C4H6S	Thiophene, 2,3-dihydro-	thiop23h
1545	C4H6S	Thiophene, 2,5-dihydro-	thiop25h
1546	CH2CHSCHCH2	Divinyl sulfide	divis
1547	C2H6N2O	Urea, methyl-	c598505
1548	C3H6O2	1,3-Dioxolane	dioxolane
1549	CH3CH2COOH	Propanoic Acid	propanoic
1550	CH3COOCH3	methyl acetate	aame
1551	HCOOC2H5	Ethyl formate	faee
1552	C2H6O2S	Dimethyl sulfone	c67710
1553	CH3SSSCH3	dimethyl trisulfide	c2h6s3
1554	C3H7NO	dimethylformamide	dmf
1555	C3H7NO	Propanamide	propanam
1556	C2H3OC2H5	Ethene, ethoxy-	c109922
1557	C4H8O	Cyclobutanol	c2919235
1558	C4H8O	Furan, tetrahydro-	thf
1559	CH2C(CH3)OCH3	1-Propene, 2-methoxy-	pre1meo2
1560	CH3COCH2CH3	2-Butanone	buta2one
1561	CHOCH(CH3)CH3	Propanal, 2-methyl-	c78842
1562	CHOCH2CH2CH3	Butanal	butanal
1563	C4H8S	Thiophene, tetrahydro-	tht
1564	C3H8O2	1,3-Propanediol	c504632
1565	C3H8O2	Hydroperoxide, 1-methylethyl	c3031752
1566	C3H8O2	Methane, dimethoxy-	c109875
1567	C3H8O2	Propylene glycol	c57556
1568	C3H8S2	1,3-Propanedithiol	c109808
1569	C4H10O	1-Butanol	butanol1
1570	C4H10O	1-Propanol, 2-methyl-	c78831
1571	C4H10O	2-Butanol, (.+/-.)-	butanol2
1572	C4H10O	Ethanol, 1,1-dimethyl-	tbuoh
1573	C4H10O	Ethoxy ethane	etoet
1574	C4H10O	Methyl propyl ether	meopr
1575	C4H10O	Propane, 2-methoxy-	c598538
1576	C4H10O+	1-Butanol cation	butanol1+
1577	C(CH3)3SH	2-Propanethiol, 2-methyl-	tbush
1578	C2H5SC2H5	Diethyl sulfide	etset
1579	C4H9SH	1-Butanethiol	bush
1580	CH2(SH)CH(CH3)CH3	1-Propanethiol, 2-methyl-	c513440
1581	CH3C(SCH3)HCH3	Propane, 2-(methylthio)-	mesipr
1582	CH3CH(SH)CH2CH3	2-Butanethiol	butansl2
1583	FNO3	Fluorine nitrate	fno3
1584	ClONO2	Chlorine nitrate	clono2
1585	BrONO2	Bromine nitrate	brono2
1586	ClO4-	perchlorate anion	clo4-
1587	BF4-	tetrafluoroboron anion	bf4-
1588	ClFO3	Perchloryl fluoride	clfo3
1589	SO2F2	Sulfuryl fluoride	so2f2
1590	SO2Cl2	Sulfuryl chloride	so2cl2
1591	F3NO	Nitrogen trifluoride oxide	f3no
1592	F3PO	Phosphoryl fluoride	pf3o
1593	Cl3PO	Phosphoryl chloride	pcl3o
1594	CF4	Carbon tetrafluoride	cf4
1595	CF3Cl	Methane, chlorotrifluoro-	cf3cl
1596	SiF4	Silicon tetrafluoride	sif4
1597	CF2Cl2	difluorodichloromethane	cf2cl2
1598	TiF4	Titanium tetrafluoride	tif4
1599	CFCl3	Trichloromonofluoromethane	cfcl3
1600	CF3Br	Bromotrifluoromethane	cf3br
1601	GeF4	Germanium tetrafluoride	gef4
1602	CCl4	Carbon tetrachloride	ccl4
1603	CCl4+	Carbon tetrachloride cation	ccl4+
1604	CBrClF2	Methane, bromochlorodifluoro-	cbrclf2
1605	SiCl4	Silane, tetrachloro-	sicl4
1606	CBrCl2F	bromodichlorofluoromethane	cbrcl2f
1607	CF3I	trifluoroiodomethane	cf3i
1608	CBrCl3	Methane, bromotrichloro-	cbrcl3
1609	CBr2F2	Methane, dibromodifluoro-	cbr2f2
1610	GeCl4	Germanium Tetrachloride	gecl4
1611	CBr2ClF	dibromochlorofluoromethane	cbr2clf
1612	CBr2Cl2	dibromodichloromethane	cbr2cl2
1613	CCl3I	trichloroiodomethane	ccl3i
1614	CFBr3	fluorotribromomethane	cfbr3
1615	CFClBrI	fluorochlorobromoiodomethane	cfclbri
1616	CBr3Cl	tribromochloromethane	cbr3cl
1617	CF2I2	difluorodiiodomethane	cf2i2
1618	CBr4	Carbon tetrabromide	cbr4
1619	CCl2I2	dichlorodiiodomethane	ccl2i2
1620	SiBr4	Silicon tetrabromide	sibr4
1621	CBr3I	tribromoiododmethane	cbr3i
1622	GeBr4	Germanium tetrabromide	gebr4
1623	CI4	tetraiodomethane	ci4
1624	SiI4	silicon tetraiodide	sii4
1625	ClOF3	Chlorine trifluoride oxide	clof3
1626	SeF4	Selenium tetrafluoride	sef4
1627	SCl4	Sulfur tetrachloride	scl4
1628	C2HF3	Trifluoroethylene	c2hf3
1629	C2HF3+	Trifluoroethylene cation	c2hf3+
1630	CHClCCl2	Trichloroethylene	chclccl2
1631	CHBrCF2	1-Bromo-2,2-difluoroethylene	chbrcf2
1632	HClO4	perchloric acid	hclo4
1633	HSO3F	Fluorosulfonic acid	hso3f
1634	CF3OH	trifluoromethanol	cf3oh
1635	CH2ClCCCl	1,3-dichloropropyne	ch2clcccl
1636	CHClCCHCl	1,3-dichloroallene	chclcchcl
1637	CHCl2CCH	3,3-dichloropropyne	chcl2cch
1638	CHCl2CHO	dichloroacetaldehyde	chcl2cho
1639	PF3CH2	phosphorane, trifluoromethylene-	pf3ch2
1640	CH3CF3	Ethane, 1,1,1-trifluoro-	ch3cf3
1641	CHF2CH2F	Ethane, 1,1,2-trifluoro	ch2fchf2
1642	CH3CF2Cl	1-Chloro-1,1-Difluoroethane	ch3cf2cl
1643	CH3CFCl2	1,1-Dichloro-1-fluoroethane	ch3cfcl2
1644	CH2ClCHCl2	1,1,2-trichloroethane	ch2clchcl2
1645	CH3CCl3	Ethane, 1,1,1-trichloro-	ch3ccl3
1646	SiCl3CH3	methyltrichlorosilane	sicl3ch3
1647	CH3CBr3	1,1,1-tribromoethane	ch3cbr3
1648	NH3BCl3	Amminetrichloroboron	nh3bcl3
1649	SiH3CCl3	(trichloromethyl)silane	sih3ccl3
1650	CH2CClCHCH2	1,3-Butadiene, 2-chloro-	c4h5cl
1651	C3H5ClO	Oxirane, (chloromethyl)-	c106898
1652	CH2FCH2CH2F	1,3-difluoropropane	ch2fch2ch2f
1653	CH3CF2CH3	2,2-difluoropropane	ch3cf2ch3
1654	CH2ClCH2CH2Cl	1,3-dichloropropane	prdicl13
1655	CH2ClCHClCH3	Propane, 1,2-dichloro-	prdicl12
1656	CH3CCl2CH3	Propane, 2,2-dichloro-	prdicl22
1657	CHCl2CH2CH3	1,1-dichloropropane	prdicl11
1658	SiCl2(CH3)2	dichlorodimethylsilane	sicl2me2
1659	CH2CClCH2CH3	1-Butene, 2-chloro-	bute1cl2
1660	CH2CHCH2CH2Cl	1-Butene, 4-chloro-	bute1cl4
1661	CH2CHCHClCH3	1-Butene, 3-chloro-	bute1cl3
1662	CH2ClCHCHCH3	2-Butene, 1-chloro-	bute2cl1
1663	CH3CClCHCH3	2-Butene, 2-chloro-, (E)-	bute2cl2e
1664	CH3CClCHCH3	2-Butene, 2-chloro-, (Z)-	bute2cl2z
1665	CHClCHCH2CH3	(E)-1-Chloro-1-butene	bute1cl1
1666	CHClCHCH2CH3	(Z)-1-Chloro-1-butene	bute1cl1z
1667	C4H9F	1-fluorobutane	butaf1
1668	CH3CHFCH2CH3	2-fluorobutane	butaf2
1669	CH2ClCH2CH2CH3	Butane, 1-chloro-	butacl1
1670	CH3CCl(CH3)CH3	Propane, 2-chloro-2-methyl-	procl2me2
1671	CH3CHClCH2CH3	Butane, 2-chloro-	butacl2
1672	XeF4	Xenon tetrafluoride	xef4
1673	C2H2N2O	Furazan	furazan
1674	CF3PH2	phosphine, (trifluoromethyl)-	cf3ph2
1675	NH3BF3	Amminetrifluoroboron	nh3bf3
1676	C6H2	hexatriyne	c6h2
1677	C6H4	(E)-Hexa-1,5-diyne-3-ene	c6h4e
1678	C6H4	(Z)-Hexa-1,5-diyne-3-ene	c6h4z
1679	C6H4	Benzyne	benzyne
1680	C6H5	phenyl	phenyl
1681	C6H5-	phenyl anion	phenyl-
1682	C6H6	Prismane	prismane
1683	C6H6	1,2,4,5-Hexatetraene	ht1245
1684	C6H6	2,4-Hexadiyne	hexadiyne
1685	C6H6	3,4-Dimethylenecyclobutene	cb34m
1686	C6H6	Benzene	benzene
1687	C6H6	Benzvalene	bv
1688	C6H6	Dewar Benzene	dewar
1689	C6H6	Hexa-1,5-diene-3-yne	hdy153
1690	C6H6	Trimethylenecycopropane	tmcp
1691	C6H6+	Benzene cation	c6h6+
1692	C6H7+	benzene, protonated	c6h7+
1693	C6H8	(E)-hexa-1,3,5-triene	c821078
1694	C6H8	(E)-hexa-2,3,4-triene	c59660650
1695	C6H8	(Z)-hexa-1,3,5-triene	hexatri135
1696	C6H8	(Z)-hexa-2,3,4-triene	hetr234c
1697	C6H8	1,3-Cyclohexadiene	cyhexadiene13
1698	C6H8	1,4-Cyclohexadiene	cyhexadiene14
1699	C6H8	3-Methylenecyclopentene	c930267
1700	C6H8	Bicyclo[2.1.1]hex-2-ene	c822413
1701	C6H8	Bicyclo[2.2.0]hex-1(4)-ene	c30830207
1702	C6H8	Bicyclo[3.1.0]hex-2-ene	c694019
1703	C6H10	1,3-Hexadiene, (E)-	hexdi13e
1704	C6H10	1,3-Hexadiene, (Z)-	hexdi13z
1705	C6H10	1,4-Hexadiene, (E)-	hexdi14t
1706	C6H10	1,4-Hexadiene, (Z)-	hexdi14z
1707	C6H10	1,5-Hexadiene	c592427
1708	C6H10	1-Butyne, 3,3-dimethyl-	c917920
1709	C6H10	1-Hexyne	hexyne1
1710	C6H10	2,4-Hexadiene, (E,E)-	hexdi24ee
1711	C6H10	2,4-Hexadiene, (E,Z)-	hexdi24ez
1712	C6H10	2,4-Hexadiene, (Z,Z)-	hexdi24zz
1713	C6H10	2-Hexyne	c764352
1714	C6H10	3-Hexyne	hexyne3
1715	C6H10	cyclohexene	cyclohexene
1716	C6H10	Cyclopentene, 1-methyl-	c693890
1717	C6H10	Cyclopentene, 3-methyl-	c1120623
1718	C6H10	Cyclopentene, 4-methyl-	c1759815
1719	C4H6(CH3)2	1,1-dimethylcyclobutane	dmcb11
1720	C6H12	(1R,2R)-1,2-dimethylcyclobutane	dmcb12t
1721	C6H12	(1r,3r)-1,3-dimethylcyclobutane	dmcb13t
1722	C6H12	(E)-2-Hexene	e2hexene
1723	C6H12	(E)-3-methylpent-2-ene	c616126
1724	C6H12	(E)-hex-3-ene	e3hexene
1725	C6H12	(Z)-3-methylpent-2-ene	c922623
1726	C6H12	(Z)-hex-2-ene	z2hexene
1727	C6H12	(Z)-hex-3-ene	z3hexene
1728	C6H12	2,3-dimethylbut-1-ene	c563780
1729	C6H12	2,3-dimethyl-but-2-ene	tmeet
1730	C6H12	3-methylenepentane	c760214
1731	C6H12	cis-1,2-dimethylcyclobutane	dmcb12c
1732	C6H12	cis-1,3-dimethylcyclobutane	dmcb13c
1733	C6H12	Cyclohexane	cyclohexane
1734	C6H12	Cyclopentane, methyl-	c96377
1735	C6H12	Ethylcyclobutane	c4806615
1736	C6H12	hex-1-ene	hexene1
1737	C6H14	Butane, 2,2-dimethyl-	buta22
1738	C6H14	Butane, 2,3-dimethyl-	buta23
1739	C6H14	Hexane	hexane
1740	C6H14	Pentane, 2-methyl-	penta2
1741	C6H14	Pentane, 3-methyl-	penta3
1742	C4N2	2-Butynedinitrile	c4n2
1743	N3P3	1,3,5,2,4,6-Triazatriphosphorine	n3p3
1744	C4H2N2	Fumaronitrile	c4h2n2
1745	C2H2N4	sym-tetrazine	ttz
1746	C3H3N3	1,3,5-Triazine	triazine135
1747	CH3N5	5-Aminotetrazole	c4418615
1748	C4H4N2	1,3-Diazine	diazine13
1749	C4H4N2	Pyrazine	pyrazine
1750	C4H4N2	Pyridazine	pyridazine
1751	C4H4N2	Succinonitrile	c110612
1752	C2H4N4	1H-Tetrazole, 1-methyl-	c16681779
1753	C2H4N4	1H-Tetrazole, 5-methyl-	c4076362
1754	C2H4N4	2H-Tetrazole, 2-methyl-	c16681780
1755	C5H5N	Bicyclo[1.1.0]butane-1-carbonitrile	bibucn
1756	C5H5N	E-2,4-pentadienenitrile	bdcn
1757	C5H5N	Pyridine	pyridine
1758	B3N3H6	borazine	borazine
1759	C5H6N+	Pyridinium	c5h6n
1760	C4H6N2	1H-Imidazole, 2-methyl-	c693981
1761	C5H7N	(E)-2-Pentenenitrile	c26294984
1762	C5H7N	(E)-3-Pentenenitrile	c16529661
1763	C5H7N	(Z)-2-Pentenenitrile	c25899507
1764	C5H7N	1H-Pyrrole, 1-methyl-	c96548
1765	C5H7N	Cyclobutanecarbonitrile	c4426113
1766	C5H9N	1,2,3,6-Tetrahydropyridine	c694053
1767	C5H9N	Butanenitrile, 2-methyl-	c18936179
1768	C5H9N	Pentanenitrile	c110598
1769	C5H9N	Propanenitrile, 2,2-dimethyl-	c630182
1770	C6H10	Bicyclo[3.1.0]hexane	c285585
1771	C5H11N	Cyclopentanamine	cypentam
1772	C5H11N	Piperidine	piper
1773	C4H12N2	1,2-Butanediamine	c4426486
1774	C4H12N2	2-Methyl-1,2-propanediamine	c811938
1775	Li2CO3	Lithium Carbonate	li2co3
1776	Na2CO3	Sodium Carbonate	na2co3
1777	C2O4--	oxalate anion	c2o4
1778	MgSO4	Magnesium Sulfate	mgso4
1779	N2O4	Dinitrogen tetroxide	n2o4
1780	C3H2O3	vinylene carbonate	vica
1781	C2H2O4	Oxalic Acid	oxalic
1782	C2H3NO3	Oxamic acid	oxamic
1783	C4H4O2	2(5H)-Furanone	furanone
1784	C4H4O2	2-Oxetanone, 4-methylene-	c674828
1785	C2H4N2O2	Oxalamide	oxalamide
1786	C2H4N2S2	Ethanedithioamide	c79403
1787	C2H4CO3	Ethylene carbonate	etco3
1788	C3H4O2S	2H-Thiete-1,1-dioxide	c7285327
1789	C3H4S3	1,3-Dithiolane-2-thione	c822388
1790	C2H4O4	Formic acid dimer	fadimer
1791	C4H5NO	3-Methylisoxazole	isox3m
1792	C4H5NO	Isoxazole, 5-methyl-	c5765446
1793	C4H5NS	4-Methylthiazole	c693958
1794	C2H5NO3	Nitric acid, ethyl ester	c625581
1795	C5H6O	2H-Pyran	pyran2
1796	C5H6O	2-methylfuran	furan2m
1797	C5H6O	3-Methylfuran	furan3m
1798	C5H6O	Pentadienal	pdal
1799	C5H6S	Thiophene, 2-methyl-	c554143
1800	C5H6S	Thiophene, 3-methyl-	c616444
1801	C4H6O2	γ–Butyrolactone	c96480
1802	C4H6O2	2,3-Butanedione	c431038
1803	C4H6O2	2-Propenoic acid, methyl ester	c96333
1804	C4H6O2	Crotonic Acid	crot
1805	C4H6OS	2,3-dihydrothiophene-2-ol	c9000117
1806	C4H6OS	2,5-dihydrothiophene-3-ol	c9000093
1807	C4H6OS	4,5-dihydrothiophene-2-ol	c9000106
1808	C4H6OS	4,5-dihydrothiophene-3-ol	c9000082
1809	C4H6OS	Dihydro-2-(3H)-thiophenone	c1003107
1810	C4H6OS	Dihydro-3-(2H)-thiophenone	c1003049
1811	C4H6OS	Vinyl sulfoxide	c1115157
1812	CH6N4S	Carbonothioic dihydrazide	thiacarb
1813	C2H6N2O2	(E)-Azodioxymethane	c37765154
1814	C2H6N2O2	Dimethylnitroamine	c4164287
1815	C3H6O3	1,3,5-Trioxane	trioxane
1816	C3H6S3	1,3,5-Trithiane	c3h6s3
1817	C3H6S3	Carbonotrithioic acid, dimethyl ester	c2314489
1818	C2H6O3S	Sulfurous acid, dimethyl ester	c616422
1819	C4H7NO	2-Pyrrolidinone	c616455
1820	C4H7NO	Ethoxyacetonitrile	etoaccn
1821	C4H7NO	Methacrylamide	c79390
1822	C4H7NO	Oxazole, 4,5-dihydro-2-methyl-	c1120645
1823	HCONH2CN2H4	formamide aminomethanimine dimer	d13
1824	C3H7ONO	Propyl nitrite	prono
1825	CH3CH(CH3)ONO	Isopropyl nitrite	c541424
1826	CH3CH(NH2)COOH	Alanine	alanine
1827	CH3NHCH2COOH	Sarcosine	sarcosine
1828	NH2CH2CH2COOH	β–alanine	betaalanine
1829	NH2COOC2H5	Urethane	urethane
1830	C5H8O	2H-Pyran, 3,4-dihydro-	c110872
1831	C5H8O	Cyclopentanone	c120923
1832	C5H8O	Furan, 2,3-dihydro-5-methyl-	c1487156
1833	C5H8O	Methyl cyclopropyl ketone	c765435
1834	N(CH3)2CONH2	Urea, N,N-dimethyl-	c598947
1835	NH(CH3)CONH(CH3)	Urea, N,N'-dimethyl-	c96311
1836	NH2CONHC2H5	Urea, ethyl-	c625525
1837	C4H8O2	1,3-Dioxane	dioxan13
1838	C4H8O2	1,3-Dioxolane, 2-methyl-	c497267
1839	C4H8O2	1,4-Dioxane	dioxan14
1840	C4H8O2	Ethene, 1,1-dimethoxy-	c922690
1841	C4H8O2	Ethyl acetate	c141786
1842	C4H8OS	s-Ethyl thioacetate	c625605
1843	C3H8O3	1,2,3-Propanetriol	glycerin
1844	C3H8O2S	(Methylsulfonyl)ethane	c594434
1845	C4H9NO	Butanamide	c541355
1846	C4H9NO	Propanamide, 2-methyl-	c563837
1847	C5H10O	2-Butanone, 3-methyl-	c563804
1848	C5H10O	2H-Pyran, tetrahydro-	c142687
1849	C5H10O	2-methylbutyraldehyde	2meba
1850	C5H10O	2-Pentanone	mpk
1851	C5H10O	3-Pentanone	dek
1852	C5H10O	Cyclopentanol	c96413
1853	C5H10O	Oxetane, 3,3-dimethyl-	c6921353
1854	C5H10O	Pentanal	pal
1855	C5H10S	2H-Thiopyran, tetrahydro-	c1613510
1856	C5H10S	3-Ethylthio-1-propene	c5296628
1857	C5H10S	Cyclopentanethiol	c1679078
1858	C5H10S	Thiophene, tetrahydro-2-methyl-	c1795091
1859	C5H10S	Thiophene, tetrahydro-3-methyl-	c4740005
1860	C4H10O2	1,1-Dimethoxyethane	c534156
1861	C4H10O2	1,3-Butanediol	budiol13
1862	C4H10O2	1,4-Butanediol	budiol14
1863	C4H10O2	Ethane, 1,2-dimethoxy-	c110714
1864	C4H10OS	Diethyl sulfoxide	c70291
1865	C4H10S2	1,4-Butanedithiol	budisl14
1866	C4H11NO	Diethylhydroxylamine	c3710847
1867	C5H12O	1-Butanol, 2-methyl-	c137326
1868	C5H12O	1-Butanol, 3-methyl-	c123513
1869	C5H12O	1-Pentanol	pentanol1
1870	C5H12O	2-Butanol, 3-methyl-	c598754
1871	C5H12O	2-Pentanol	peol2
1872	C5H12O	3-Pentanol	pentan3ol
1873	C5H12O	Butane, 1-methoxy-	meobu
1874	C5H12O	Propane, 1-ethoxy-	proet
1875	C5H12O	Propane, 2-methoxy-2-methyl-	c1634044
1876	C5H12S	1-Butanethiol, 2-methyl-	c1878188
1877	C5H12S	1-Butanethiol, 3-methyl-	c541311
1878	C5H12S	1-Pentanethiol	c110667
1879	C5H12S	1-Propanethiol, 2,2-dimethyl-	c1679089
1880	C5H12S	2-Butanethiol, 2-methyl-	c1679090
1881	C5H12S	2-Butanethiol, 3-methyl-	c2084186
1882	C5H12S	Butane, 1-(methylthio)-	c628295
1883	C5H12S	Ethyl propyl sulfide	c4110503
1884	C5H12S	Propane, 2-(ethylthio)-	c5145993
1885	C5H12S	Propane, 2-methyl-2-(methylthio)-	c6163640
1886	C4F2	difluorobutadiyne	c4f2
1887	ClCOClCO	Oxalyl chloride	oxcl
1888	CF3CN	Acetonitrile, trifluoro-	cf3cn
1889	CF3CN+	Acetonitrile, trifluoro- cation	cf3cn+
1890	B2F4	Diboron tetrafluoride	b2f4
1891	B2Cl4	Diboron tetrachloride	b2cl4
1892	C2F4	Tetrafluoroethylene	c2f4
1893	C2F4+	Tetrafluoroethylene cation	c2f4+
1894	C2ClF3	Ethene, chlorotrifluoro-	c2f3cl
1895	CF2CCl2	difluorodichloroethylene	cf2ccl2
1896	CFClCClF	trans-1,2-dichloro-1,2-difluoroethylene	cfclcclf
1897	CFClCFCl	cis-1,2-dichloro-1,2-difluoroethylene	cfclcfcl
1898	C2FCl3	fluorotrichloroethene	c2fcl3
1899	C2Cl4	Tetrachloroethylene	c2cl4
1900	C2Br4	tetrabromoethene	c2br4
1901	CF3OF	Trifluoromethylhypofluorite	cf3of
1902	SiF5-	silicon pentafluoride anion	sif5-
1903	SOF4	Sulfur tetrafluoride oxide	sof4
1904	PF5	Phosphorus pentafluoride	pf5
1905	AsF5	Arsenic pentafluoride	asf5
1906	PCl5	Phosphorus pentachloride	pcl5
1907	SF5	Sulfur pentafluoride	sf5
1908	SF5+	pentafluoro sulfur cation	sf5+
1909	SbCl5	Antimony pentachloride	sbcl5
1910	BrF5	bromine pentafluoride	brf5
1911	ClF5	chlorinepentafluoride	clf5
1912	IF5	pentafluoroiodine	if5
1913	CF3CHO	trifluoroacetaldehyde	cf3cho
1914	CCl3CHO	trichloroacetaldehyde	ccl3cho
1915	CHFClCHClF	ethane, 1,2-dichloro-1,2-difluoro-	chfclchclf
1916	CF3CH2F	1,1,1,2-tetrafluoroethane	cf3ch2f
1917	CHF2CHF2	1,1,2,2-tetrafluoroethane	chf2chf2
1918	CF3CH2Cl	2,2,2-Trifluoroethyl chloride	cf3ch2cl
1919	CHFClCHFCl	1,2-dichloro-1,2-difluoroethane RR	chfclchfcl
1920	CH2ClCCl3	1,1,1,2-tetrachloroethane	ch2clccl3
1921	CHCl2CHCl2	Ethane, 1,1,2,2-tetrachloro-	chcl2chcl2
1922	CH2BrCBr3	1,1,1,2-tetrabromo ethane	c2h2br4
1923	CHCl2CHF2	1,1-dichloro-2,2-difluoroethane	c2h2cl2f2
1924	CF3COOH	trifluoroacetic acid	cf3cooh
1925	C4H3ClO	Furan, 2-chloro	fur2cl
1926	C4H3ClO	Furan,3-chloro	fur3cl
1927	C3H5ClO2	Carbonochloridic acid, ethyl ester	c541413
1928	C3H5Cl3	Propane, 1,2,3-trichloro-	prcl135
1929	C4H8Cl2	1,4-Dichlorobutane	c110565
1930	C4H8Cl2	Butane, 1,2-dichloro-	c616217
1931	C4H8Cl2	Butane, 1,3-dichloro-	c1190223
1932	C4H8Cl2	Butane, 2,3-dichloro-, (r*,r*)-(.+/-.)-	c2211678
1933	C4H8Cl2	Butane, 2,3-dichloro-, (r*,s*)-	c4028562
1934	C4H9ClO	1-Chloro-2-ethoxyethane	c628342
1935	C5H11Cl	Pentane, 1-chloro-	pencl1
1936	C4H8O2	Butanoic acid	bua
1937	C6H5CH2	benzyl radical	benzyl
1938	C7H7	cycloheptatrienyl radical	c7h7
1939	C7H7+	cycloheptatrienyl cation	c7h7+
1940	C6H5CH3	toluene	toluene
1941	C7H8	cycloheptatriene	cht
1942	C7H8	Norbornadiene	norbor
1943	C7H8	Quadricyclane	qucy
1944	C7H12	Norbornane	nor
1945	C7H14	cycloheptane	c7h14
1946	C7H16	2-methylhexane	2mhex
1947	C7H16	3-methylhexane	hex3m
1948	C7H16	heptane	heptane
1949	CH(CN)3	tricyanomethane	mecn3
1950	HN=C=C(CN)2	Dicyanoketenimine	c4hn3
1951	C6H7N	2-Methylpyridine	mp
1952	C6H5NH2	aniline	aniline
1953	C6H13N	2-Methylpiperidine	pip2m
1954	C6H13N	cyclohexanamine	cham
1955	C6H15N	triethylamine	tea
1956	N2O5	Dinitrogen pentoxide	n2o5
1957	C4H2O3	Maleic Anhydride	malan
1958	C5H4O2	4-Cyclopentene-1,3-dione	cpdio
1959	C5H4O2	furfural	furfural
1960	C6H5O	phenoxy radical	phenoxy
1961	C5H5NO	2(1H)-Pyridinone	c72762006
1962	C5H5NO	2(3H)-Pyridinone	c9000048
1963	C5H5NO	2(5H)-Pyridinone	c9000037
1964	C5H5NO	2-Pyridinol	c109104
1965	C5H5NO	3(2H)-Pyridinone	c9000004
1966	C5H5NO	3(4H)-Pyridinone	c9000026
1967	C5H5NO	3(6H)-Pyridinone	c9000015
1968	C5H5NO	3-Pyridinol	c109002
1969	C5H5NO	4(1H)-Pryidinone	c9000060
1970	C5H5NO	4(3H)-Pryidinone	c9000059
1971	C5H5NO	4-Pyridinol	c626642
1972	C6H5OH	phenol	phenol
1973	C6H6O	2,4-Cyclohexadienone	c24599573
1974	C6H6O	2,5-Cyclohexadienone	c5664335
1975	C6H5SH	Benzenethiol	phsh
1976	HO2CCHNH2CH2OH	Serine	serine
1977	C5H8O2	Acetylacetone	acac
1978	C4H8O2S	Sulfolane	sulfolane
1979	C7H10	Norbornene	norbornene
1980	CH(C2H3)3	trivinyl methane	tvm
1981	C6H10O	cyclohexanone	chexo
1982	C6H12O	hexanal	c6h12o
1983	C6H12O	Oxepane	oxepane
1984	C3H7OC3H7	di-n-propyl ether	propr
1985	F2CCCF2	tetrafluoroallene	pfa
1986	CF3COO-	trifluoro acetate anion	cf3coo-
1987	CF3COF	trifluoroacetyl fluoride	cf3cof
1988	CF3COCl	trifluoroacetyl chloride	cf3cocl
1989	PF6	Hexafluorophosphate neutral	pf6
1990	PF6-	Hexafluorophosphate ion	pf6-
1991	SF6	Sulfur Hexafluoride	sf6
1992	SeF6	Selenium hexafluoride	sef6
1993	SF5Cl	sulfur chloropentafluoride	sf5cl
1994	CF3CHF2	pentafluoroethane	cf3chf2
1995	CF3CHFCl	1,1,1,2-tetrafluorochloroethane	cf3chfcl
1996	CF3CHCl2	1,1-Dichloro-2,2,2-trifluoroethane	cf3chcl2
1997	CHCl2CClF2	Ethane, 1,2,2-trichloro-1,1-difluoro-	chcl2cclf2
1998	CCl3CHCl2	pentachloroethane	ccl3chcl2
1999	C6H5F	Fluorobenzene	bzf
2000	C6H5Cl	chlorobenzene	bzcl
2001	C6H5Br	bromobenzene	bzbr
2002	C8H6	Calicene	calicene
2003	C6H5CCH	phenylacetylene	phac
2004	C8H6	benzocyclobutadiene	bcbd
2005	C8H6	Pentalene	pentalene
2006	C6H5CHCH2	Styrene	styrene
2007	C8H8	cubane	cubane
2008	C8H8	cyclooctatetraene	cot
2009	C6H5CH2CH3	Ethylbenzene	etbz
2010	CH3C6H4CH3	meta-xylene	mxylene
2011	CH3C6H4CH3	paraxylene	pxylene
2012	C8H14	Bicyclo[2.2.2]octane	bico222
2013	C8H16	cyclooctane	cyclooct
2014	(CH3)3CC(CH3)3	tetramethylbutane	tmb
2015	C8H18	Octane	c8h18
2016	C6H5CN	phenyl cyanide	phcn
2017	C6H12N2	Triethylenediamine	ted
2018	C4O4--	squarate dianion	c4o4--
2019	S4N4	Tetrasulfur tetranitride	s4n4
2020	S8	Octasulfur	s8
2021	C6H4O2	parabenzoquinone	pbq
2022	C4H4N2O2	Uracil	uracil
2023	C6H5CHO	benzaldehyde	benzal
2024	C6H5OCH3	Anisole	anisole
2025	C5H9NO2	Proline	proline
2026	C6H12O2	Methyl pivalate	c598981
2027	C6H12O2	Hexanoic acid	hexa
2028	C4F4	tetrafluorcyclobutadiene	c4f4
2029	Al2Cl6	Aluminum, di-μ-chlorotetrachlorodi-	al2cl6
2030	CF3CF2Cl	pentafluorochloroethane	cf3cf2cl
2031	CF2ClCF2Cl	1,2-Dichloro-1,1,2,2-tetrafluoroethane	cf2clcf2cl
2032	CF3CFCl2	1,1-Dichlorotetrafluoroethane	cf3cfcl2
2033	CF2ClCFCl2	Ethane, 1,1,2-trichloro-1,2,2-trifluoro-	cf2clcfcl2
2034	CF3CCl3	1,1,1-trifluoro-2,2,2-trichloroethane	cf3ccl3
2035	C2F6	hexafluoroethane	c2f6
2036	IF7	Iodine heptafluoride	if7
2037	C6H4F2	metadifluorobenzene	mdfb
2038	C6H4F2	orthodifluorobenzene	odfb
2039	C6H4F2	1,4-difluorobenzene	pdfb
2040	C6H4Cl2	1,2-dichlorobenzene	dcb12
2041	C6H4Cl2	1,3-dichlorobenzene	dcb13
2042	C6H4Cl2	1,4-dichlorobenzene	dcb14
2043	C6H5NO	nitrosobenzene	bzno
2044	C9H8	Indene	indene
2045	C9H8	spiro[4.4]nona-1,3,6,8-tetraene	snt
2046	C9H12	n-propyl benzene	prbz
2047	C9H20	Nonane	nonane
2048	C(CN)4	tetracyanomethane	c5n4
2049	C5H4N4	purine	purine
2050	C8H7N	Indole	indole
2051	C3H3N3O3	cyanuric acid	cyanuric
2052	C6H5NO2	Nitrobenzene	c6h5no2
2053	C6H5COOH	benzoic acid	benzo
2054	CH3COC6H5	acetophenone	acph
2055	C3Cl3N3	1,3,5-Triazine, 2,4,6-trichloro-	c3cl3n3
2056	C3F6	hexafluoropropene	c3f6
2057	C6H3F3	Benzene trifluoride 123	bzf3a
2058	C8H18O	1-Octanol	octanol
2059	C10H8	Azulene	azu
2060	C10H8	naphthalene	naph
2061	C10H10	bullvalene	bullv
2062	C10H16	adamantane	adamantane
2063	C6N4	Tetracyanoethylene	tcne
2064	C6N4-	tetracyanoethylene anion	tcne-
2065	C10H22	Decane	decane
2066	C4F6	perfluorobutadiene	c4f6
2067	SF5CF3	Sulfur, pentafluoro(trifluoromethyl)-	sf5cf3
2068	C3F8	perfluoropropane	c3f8
2069	Fe(CO)5	Iron pentacarbonyl	ipc
2070	Fe(C5H5)2	ferrocene	fecp2
2071	B12H12--	Dodecahydrododecaborate(2-)	b12h12--
2072	B12H12--	Dodecahydrododecaborate(2-)	b12h12--
2073	C12H8	Acenaphthylene	acenaph
2074	C12H8	biphenylene	biph
2075	C12H10	biphenyl	biphenyl
2076	C12H10	Heptalene	heptalene
2077	C6H12O6	Inositol	inositol
2078	C6F6	hexafluorobenzene	c6f6
2079	S2F10	disulphur decafluoride	s2f10
2080	C13H10	Fluorene	fluorene
2081	C14H10	Anthracene	anth
2082	C14H10	Phenanthrene	phenanthrene
2083	C14H14	Bibenzyl	bibenzyl
2084	C12H10N2	azobenzene	azobenzene
2085	C6H5COC6H5	benzophenone	benzophenone
2086	C16H10	Pyrene	pyrene
2087	C18H12	Tetracene	tetracene
2088	C19H16	Triphenylmethane	tpm
2089	C24H12	Coronene	coronene
2090	C60	Buckminsterfullerene	c60