National Institute of Standards and Technology

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

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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 MP2 /6-311+G(3df,2p)

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count	Species	Name	State	Conformation
1	H	Hydrogen atom	1S	Kh
2	H+	Hydrogen atom cation		Kh
3	H2	Hydrogen diatomic	1Σg	D∞h
4	He	Helium atom	1S	Kh
5	He	Helium atom
6	He+	Helium atom cation	2S	Kh
7	HeH+	Helium hydride cation	1Σ	C∞v
8	He2+	helium diatomic cation	2Σu	D∞h
9	Li	Lithium atom	2S	Kh
10	Li+	Lithium atom cation	1S	Kh
11	Na	Sodium atom	2S	Kh
12	Na+	Sodium atom cation	1S	Kh
13	K	Potassium atom	2S	Kh
14	Cu	Copper atom	2S	Kh
15	LiH	Lithium Hydride	1Σ	C∞v
16	KH	Potassium hydride	1Σ	C∞v
17	Be	Beryllium atom	1S	Kh
18	Be+	Beryllium atom cation	2S	Kh
19	Mg	Magnesium atom	1S	Kh
20	Mg+	Magnesium atom cation	2S	Kh
21	Zn	Zinc atom	1S	Kh
22	MgH	magnesium monohydride	2Σ	C∞v
23	ZnH+	Zinc, protonated
24	BeH2+	Beryllium dihydride cation
25	B	Boron atom	2P	Kh
26	B	Boron atom	4P	Kh
27	B+	Boron atom cation	1S	Kh
28	Al	Aluminum atom	2P	Kh
29	Al-	Aluminum atom anion	3P	Kh
30	Al+	Aluminum atom cation	1S	Kh
31	Ga	Gallium atom	2P
32	Ga-	Gallium atom anion	3P	Oh
33	Ga+	Gallium atom cation	1S
34	GaH	Gallium monohydride	1Σ	C∞v
35	GaH+	Gallium monohydride cation	2Σ	C∞v
36	BH3+	boron trihydride cation	2B2	C2v
37	BH3+	boron trihydride cation		C2v
38	AlH3-	aluminum trihydride anion		C3v
39	BH4-	borohydride anion	1A1	Td
40	C	Carbon atom	3P0	Kh
41	C	Carbon atom	3P1	Kh
42	C+	Carbon atom cation	2P	Kh
43	Si	Silicon atom	3P	Kh
44	Si	Silicon atom	1S	Kh
45	Si-	Silicon atom anion	4S	Kh
46	Si+	Silicon atom cation	2P	Kh
47	Ge	Germanium atom	3P	Kh
48	Ge-	Germanium anion	4S	Kh
49	Ge+	Germanium cation	2P	Kh
50	CH	Methylidyne	2Π1/2	C∞v
51	SiH	Silylidyne	2Π	C∞v
52	GeH	germylidene	2Π	C∞v
53	CH2-	methylene anion	2B1	C2v
54	GeH2	germylene	1A1	C2v
55	CH3	Methyl radical	2A1	D3h
56	SiH3	Silyl radical	2A1	C3v
57	SiH3+	Silyl cation	1A1'	D3h
58	GeH3	Germyl radical	2A1	C3v
59	GeH3+	germyl cation	1A1'	D3h
60	CH4	Methane	1A1	Td
61	SiH2D2	silane-d2
62	SiH4	Silane	1A1	Td
63	GeH4	Germane	1A1	Td
64	SiH5+	Silane, protonated
65	N	Nitrogen atom	4S	Kh
66	N+	Nitrogen atom cation	3P	Kh
67	P	Phosphorus atom	4S	Kh
68	V+	Vanadium atom cation	5D	Kh
69	As	Arsenic atomic	4S	Kh
70	As-	Arsenic anion	3P	Kh
71	As+	Arsenic cation	3P	Kh
72	PH	phosphorus monohydride	3Σ-	C∞v
73	AsH	Arsenic monohydride	3Σ	C∞v
74	NH2	Amino radical	2B1	C2v
75	NH2+	Amino cation	3B1	C2v
76	NH2+	Amino cation	1A1	C2v
77	NH3	Ammonia	1A1	C3v
78	PH3	Phosphine	1A1	C3v
79	PH3+	Phosphine cation	2A1	C3v
80	AsH3	Arsine	1A1	C3v
81	AsH3+	Arsine cation	2A1	C3v
82	AsH4+	Arsonium
83	NH4	Ammonium radical
84	PH4	Phosphoranyl radical
85	O	Oxygen atom	3S	Kh
86	O+	Oxygen atom cation	4S	Kh
87	S	Sulfur atom	3P	Kh
88	S	Sulfur atom
89	Se	Selenium atom	3P	Kh
90	Se-	Selenium atom anion	2P	Kh
91	Se+	Selenium atom cation	4S	Kh
92	OH	Hydroxyl radical	2Π	C∞v
93	OH+	hydoxyl cation	3Σ	C∞v
94	HS-	mercapto anion	1Σ	C∞v
95	HS+	sulfur monohydride cation	3Σ	C∞v
96	CrH+	Chromium hydride cation	5Σ	C∞v
97	HSe	Selenium monohydride	2Π	C∞v
98	HSe-	selenium monohydride anion	1Σ	C∞v
99	HSe+	selenium monohydride cation	3Σ	C∞v
100	H2O	Water	1A1	C2v
101	H2O-	water anion	2A1	C2v
102	H2O-	water anion	2A'	Cs
103	H2O+	water cation	2B1	C2v
104	HDO	Water-d1	1A1	C2v
105	H2S+	Hydrogen sulfide cation	2B1	C2v
106	H2Se	Hydrogen selenide	1A1	C2v
107	H2Se+	Hydrogen selenide cation	2B1	C2v
108	H3S+	Sulfonium cation	1A1	C3v
109	H3Se+	Hydrogen Selenide, protonated	1A1	C3v
110	F	Fluorine atom	2P	Kh
111	F+	Fluorine atom cation	3S	Kh
112	Cl	Chlorine atom	2P	Kh
113	Cl+	Chlorine atom cation	3P	Kh
114	Br	Bromine atom	2P	Kh
115	Br-	Bromine atom anion	1S	Kh
116	Br+	Bromine atom cation	3P	Kh
117	HF	Hydrogen fluoride	1Σ	C∞v
118	HF-	hydrogen fluoride anion	2Σ	C∞v
119	HF+	hydrogen fluoride cation	2Π	C∞v
120	HCl	Hydrogen chloride	1Σ	C∞v
121	HCl-	hydrogen chloride anion	2Σ	C∞v
122	HCl+	hydrogen chloride cation	2Π	C∞v
123	HBr	hydrogen bromide	1Σ	C∞v
124	HBr-	hydrogen bromide anion	2Σ	C∞v
125	HBr+	hydrogen bromide cation	2Π	C∞v
126	H2Cl+	dihydrogen monochloride cation	1A1	C2v
127	H2Br+	protonated hydrogen bromide	2A1	C2v
128	Ne	Neon atom	1S	Kh
129	Ne	Neon atom
130	Ne+	Neon atom cation	2P	Kh
131	Ar	Argon atom	1S	Kh
132	Kr	Krypton atom	1S	Kh
133	Kr+	Krypton cation	2P	Kh
134	HeLi+	Helium Lithium cation
135	ArH+	Argon hydride cation	1Σ	C∞v
136	KrH+	Protonated Krypton	1Σ	C∞v
137	NaLi	lithium sodium	1Σ	C∞v
138	Na2	Sodium diatomic	1Σg	D∞h
139	Na2-	sodium diatomic anion	2Σu	D∞h
140	LiAl	Lithium Aluminum
141	HBBH	Diborane(2)	3ΣG	D∞h
142	B2H4	Diborane(4) D2d	1A1	D2d
143	B2H6	Diborane	1Ag	D2h
144	B2H6+	Diborane cation
145	CaC	Calcium monocarbide
146	BSi	Boron silicide	4Σ	C∞v
147	BSi	Boron silicide	2Σ	C∞v
148	Si2	Silicon diatomic	3Σg	D∞h
149	GeC	Germanium monocarbide	1Σ	C∞v
150	SiGe	Silicon Germanium
151	C2H-	Ethynyl anion	1Σ	C∞v
152	C2H2	Acetylene	1Σg	D∞h
153	C2H2+	acetylene cation	2Πu	D∞h
154	C2H2+	acetylene cation
155	H2CC-	vinylidene anion
156	HCCH-	acetylene anion
157	HCCH-	acetylene anion
158	Si2H2	disilyne
159	Si2H2	disilyne
160	Si2H2	disilyne
161	Si2H2	disilyne
162	CH3Li	methyl lithium	1A1	C3v
163	C2H3	vinyl	2A'	Cs
164	C2H3+	vinyl cation	1A1	C2V bridging H
165	C2H3+	vinyl cation	1A1	C2V HCCH2
166	C2H4	Ethylene	1Ag	D2h
167	C2H4+	Ethylene cation	2B3	D2
168	Si2H4	Disilene
169	Si2H4	Disilene
170	Si2H4	Disilene
171	C2H5	Ethyl radical	2A'	Cs
172	C2H6	Ethane	1A1g	D3d
173	Si2H6	disilane	1Eu	D3d
174	LiN	Lithium Nitride	3Σ	C∞v
175	LiP	Lithium monophosphide
176	LiP	Lithium monophosphide
177	MgN	Magnesium Nitride
178	MgN	Magnesium Nitride
179	GaAs	Gallium arsenide	3Π
180	GaAs	Gallium arsenide	1Σ
181	CN	Cyano radical	2Σ	C∞v
182	SiP	Silicon monophosphide	2Π	C∞v
183	N2	Nitrogen diatomic	1Σg	D∞h
184	N2	Nitrogen diatomic
185	PN	Phosphorus mononitride	1Σ	C∞v
186	HCN	Hydrogen cyanide	1Σ	C∞v
187	HCN+	hydrogen cyanide cation	2Π	C∞v
188	HNC+	hydrogen isocyanide cation
189	HCP+	Phosphaethyne cation
190	NNH+	Dinitrogen monohydride cation	1Σ	C∞v
191	LiNH2	lithium amide
192	HBNH	Boranimine	1Σ	C∞v
193	H2NN	Isodiazene
194	N2H2+	trans-diazene cation	2AG	C2h
195	CH2NH	Methanimine	1A'	Cs
196	CH2NH+	Methanimine cation
197	CHNH2	aminomethylene
198	CHNH2+	Aminocarbene cation
199	BH2NH2	Boranamine
200	N2H4	Hydrazine	1A	C2
201	CH3NH2	methyl amine	1A'	Cs
202	SiH3NH2	Silane, amino
203	BH3PH3	borane phosphine
204	BH3NH3	borane ammonia	1A1	C3v
205	CH3NH3	methyl ammonium radical	2A1	C3v
206	N2H7+	ammonia ammonium dimer
207	LiO	lithium oxide	2Σ	C∞v
208	LiSe	Lithium monoselenide
209	CaO	Calcium monoxide	1Σ	C∞v
210	CaS	Calcium sulfide	1Σ	C∞v
211	BO	boron monoxide	2Σ	C∞v
212	GaO	Gallium monoxide	2Σ	C∞v
213	GaS	Gallium monosulfide
214	CO	Carbon monoxide	1Σ	C∞v
215	CO-	carbon monoxide anion	2Π	C∞v
216	CO+	carbon monoxide cation	2Σ	C∞v
217	SiO	Silicon monoxide	1Σ	C∞v
218	SiS	silicon monosulfide	1Σ	C∞v
219	CSe	Carbon monoselenide	1Σ	C∞v
220	GeO	Germanium monoxide	1Σ	C∞v
221	SiSe	Silicon Monoselenide
222	SiSe+	Silicon Monoselenide cation
223	GeSe	Germanium monoselenide
224	NO	Nitric oxide	2Π	C∞v
225	NO-	nitric oxide anion	3Σ	C∞v
226	NO+	nitric oxide cation	1Σ	C∞v
227	PO	Phosphorus monoxide	2Π	C∞v
228	PS	phosphorus sulfide	2Σ	C∞v
229	NSe	Nitrogen monoselenide	2Π	C∞v
230	AsS	Arsenic monosulfide	2Π	C∞v
231	PSe	Phosphorus monoselenide	2Π	C∞v
232	AsSe	Arsenic monoselenide	2Π	C∞v
233	O2	Oxygen diatomic	3Σg	D∞h
234	O2--	dioxygen dianion
235	SO	Sulfur monoxide	3Σ	C∞v
236	SO	Sulfur monoxide	1Σ	C∞v
237	SO+	sulfur monoxide cation	2Π	C∞v
238	S2	Sulfur diatomic	3Σg	D∞h
239	SeO	Selenium monoxide	3Σ	C∞v
240	Se2	Selenium diatomic	3Σg	D∞h
241	LiOH	lithium hydroxide	1Σ	C∞v
242	NaOH	sodium hydroxide	1Σ	C∞v
243	KOH	Potassium hydroxide	1Σ	C∞v
244	BeOH	beryllium monohydroxide	2A'	Cs
245	HBO	Boron hydride oxide	1Σ	C∞v
246	HBS	hydrogen boron sulfide	1Σ	C∞v
247	COH	Hydroxymethylidyne
248	HCO	Formyl radical	2A'	Cs
249	HCO-	formyl anion	1A'	Cs
250	HCO+	Formyl cation	1Σ	C∞v
251	HNO	Nitrosyl hydride	1A'	Cs
252	HNO+	Nitrosyl hydride cation	2A'	Cs
253	HSO+	Sulfur Monoxide, S-protonated
254	SOH	Sulfur Hydroxide
255	SOH+	Sulfur Monoxide, protonated
256	H2CO	Formaldehyde	1A1	C2v
257	H2CO-	formaldehyde anion	2A'	Cs
258	H2CO-	formaldehyde anion
259	H2CO+	formaldehyde cation	2B2	C2v
260	H2CS	Thioformaldehyde	1A1	C2v
261	H2CS-	thioformaldehyde anion
262	H2CS-	thioformaldehyde anion
263	H2CSe	Selenoformaldehyde
264	H2O2	Hydrogen peroxide	1A	C2
265	H2O2	Hydrogen peroxide	1Ag	C2h
266	H2OO	water oxide
267	HOSH	hydrogen thioperoxide
268	H2Se2	hydrogen diselenide
269	CH2OH+	hydroxymethyl cation	1A'	Cs
270	CH3O-	methoxy anion	1A1	C3v
271	NH2OH	hydroxylamine	1A'	Cs
272	NH2OH+	Hydroxylamine cation
273	NH2SH	Thiohydroxylamine
274	NH2SH	Thiohydroxylamine
275	NH3S	sulfidoazane
276	CH3OH	Methyl alcohol	1A'	Cs
277	CH3OH+	Methyl alcohol cation	2A"	Cs
278	CH3SH	Methanethiol	1A'	Cs
279	SiH3OH	silanol
280	NH2OH2+	protonated hydroxylamine
281	NH3OH+	N-protonated hydroxylamine
282	H5O2+	Dihydroxonium ion	1A	C2
283	LiF	lithium fluoride	1Σ	C∞v
284	LiCl	lithium chloride	1Σ	C∞v
285	NaF+	sodium fluoride cation	2Σ	C∞v
286	LiBr	Lithium Bromide	1Σ	C∞v
287	LiF+	lithium fluoride cation	2Π	C∞v
288	CaBr	Calcium monobromide
289	BF	Boron monofluoride	1Σ	C∞v
290	AlF	Aluminum monofluoride	1Σ+	C∞v
291	GaF	Gallium monofluoride	1Σ	C∞v
292	AlBr	Aluminum monobromide
293	GaCl	Gallium monochloride	1ΣG	C∞v
294	GaBr	Gallium monobromide
295	CF	Fluoromethylidyne	2Π	C∞v
296	SiCl	Clorosilylidyne	2Π	C∞v
297	CBr	Carbon monobromide	2Π	C∞v
298	GeF	Germanium monofluoride	2Π	C∞v
299	GeCl	Germanium monochloride	2Π	C∞v
300	GeCl+	Germanium monochloride cation
301	SiBr	Silicon monobromide	2Π	C∞v
302	SiBr+	Silicon monobromide cation
303	NCl	nitrogen monochloride	3Σ	C∞v
304	PBr	Phosphorus monobromide
305	ClO	Monochlorine monoxide	2Π	C∞v
306	ClO+	chlorine monoxide cation	3Σ	C∞v
307	SF	Monosulfur monofluoride	2Π	C∞v
308	SF+	sulfur monofluoride cation	3Σ	C∞v
309	SCl+	sulfur monochloride cation	3Σg	C∞v
310	BrO	Bromine monoxide	2Π	C∞v
311	BrO+	Bromine monoxide cation
312	SBr	Sulfur monobromide radical
313	SBr+	Sulfur monobromide cation
314	SeBr	Selenium monobromide
315	BrCl	Bromine monochloride	1Σ	C∞v
316	F2	Fluorine diatomic	1Σg	D∞h
317	F2+	flourine diatomic cation	2Πg	D∞h
318	ClF	Chlorine monofluoride	1Σ+	C∞v
319	ClF+	clorine monofluoride cation	2Π	C∞v
320	Cl2	Chlorine diatomic	1Σg	D∞h
321	Cl2+	chlorine diatomic cation	2Πg	D∞h
322	BrF	Bromine monofluoride	1Σ	C∞v
323	Br2	Bromine diatomic	1Σg	D∞h
324	Br2-	bromine diatomic anion	2Σu	D∞h
325	Br2+	bromine diatomic cation	2Πg	D∞h
326	HCF	Fluoromethylene	1A'	Cs
327	HCF	Fluoromethylene	3A"	Cs
328	HSiF	fluorosilylene
329	HSiCl	Chlorosilylene
330	HSiBr	monobromosilylene
331	HOF	Hypofluorous acid	1A'	Cs
332	HOCl	hypochlorous acid	1A'	Cs
333	HOCl+	hypochlorous acid cation
334	F2H+	Fluorine, protonated	1A'	Cs
335	ClFH+	Chlorine fluoride, F-protonated
336	FClH+	Chlorine fluoride, Cl-protonated
337	Cl2H+	Chlorine, protonated	1A'	Cs
338	CH2Br	bromomethyl radical
339	CH2F	fluoromethyl radical	2A	Cs
340	CH2F+	fluoromethyl cation
341	CH2Cl+	chloromethyl cation
342	CH2Cl	chloromethyl radical	2A'	Cs
343	CH2Cl	chloromethyl radical	2B1	C2v
344	NH2Cl	chloramine	1A'	Cs
345	CH3F+	methyl fluoride cation
346	CH3F	Methyl fluoride	1A1	C3v
347	CH3Cl	Methyl chloride	1A1	C3v
348	CH3Cl+	Methyl chloride cation
349	SiH3F	monofluorosilane	1A1	C3v
350	SiH3Cl	chlorosilane	1A1	C1
351	CH3Br	methyl bromide	1A1	C3v
352	GeH3F	monofluorogermane
353	GeH3Cl	monochlorogermane
354	NH3Cl+	protonated monochloroammonia
355	CH3ClH+	methyl chloride, protonated
356	NH4Cl	Ammonium chloride
357	LiNe+	Lithium Neon cation
358	Ar2	Argon diatomic	1Sg	D∞h
359	C3	carbon trimer	1Σg	D∞h
360	C3	carbon trimer	1A1	C2v
361	SiC2	Silicon dicarbide
362	C3H4	cyclopropene	1A1	C2v
363	CH2CCH2	allene	1A1	D2d
364	CH3CCH	propyne	1A'	C3v
365	C3H5	Allyl radical	2A2	C2v
366	C3H6	Cyclopropane	1A1'	D3h
367	CH2CHCH3	Propene	1A'	Cs
368	C3H7	n-Propyl radical	2A"	C1
369	CH3CHCH3	Isopropyl radical	2A	C2
370	CH3CHCH3+	Isopropyl cation	1A	C2
371	C3H8	Propane	1A1	C2v
372	Si3H8	trisilane
373	LiCN	lithium cyanide	1Σ	C*V LiCN
374	KCN	Potassium cyanide	1Σ	C∞v
375	KCN	Potassium cyanide	1Σ	C∞v
376	KCN	Potassium cyanide	1A'	Cs
377	ZnCN	Zinc monocyanide	2Σ	C∞v
378	ZnNC	Zinc isocyanide	2Σ	C∞v
379	AlCN	Aluminum monocyanide
380	AlNC	Aluminum isocyanide
381	CNN	Diazocarbene
382	N3	azide radical	2Πg	D∞h
383	HN3	hydrogen azide	1A'	Cs
384	HN3+	Hydrazoic acid cation
385	HNCNH	diiminomethane	1A	C2
386	HNNNH+	1,2-Triazadienium
387	NH2NN+	hydrazoic acid, protonated
388	CH3CN	Acetonitrile	1A1	C3v
389	CH3CN-	acetonitrile anion	2E	C3v
390	CH3CN-	acetonitrile anion	2A'	Cs
391	CHNCH2	2H-Azirine
392	CHNHCH	1H-Azirine
393	H2CCNH	Ethenimine
394	H2CNCH	methyleneaminomethylene
395	HCCNH2	Ethynamine
396	HCNCH2+	2H-Azirine cation
397	NH2CNH+	cyanamide, cn protonated
398	NH3CN+	cyanamide, amine protonated
399	C2H6N+	aziridine, protonated	1A1	C2v
400	CH3CH2NH2	Ethylamine
401	Li2O	dilithium oxide	1Σg	D∞h
402	Na2O	disodium monoxide	1Σg	Linear
403	Na2O	disodium monoxide	1A1	C2v
404	Na2S	Sodium sulfide
405	Na2S	Sodium sulfide
406	LiO2	Lithium dioxide
407	NaO2	Sodium superoxide
408	NCO	isocyanato radical	2Π	C∞v
409	N2O	Nitrous oxide	1Σ	C∞v
410	CO2	Carbon dioxide	1Σg	D∞h
411	OCS	Carbonyl sulfide	1Σ	C∞v
412	CS2	Carbon disulfide	1Σg	D∞h
413	GeO2	Germanium dioxide	1Σg	D∞h
414	OCSe	Carbonyl selenide	1Σ	C∞v
415	SCSe	Carbon sulfide selenide
416	NO2	Nitrogen dioxide	2A1	C2v
417	NSO	sulfinyl amidogen
418	SNO	Nitrogen oxide sulfide
419	SO2	Sulfur dioxide	1A1	C2v
420	SSO	Disulfur monoxide	1A'	Cs
421	S3	Sulfur trimer	1A1	C2v
422	S3	Sulfur trimer
423	SeO2	Selenium dioxide	1A1	C2v
424	HCCO	ketenyl radical	2Π	C∞v
425	HCCO	ketenyl radical	2A"	Cs
426	HCNO	fulminic acid	1Σ	C∞v
427	HNCS	Isothiocyanic acid
428	HSCN	thiocyanic acid	1A'	Cs
429	HOCO	Hydrocarboxyl radical	1A'	cis
430	HOCO	Hydrocarboxyl radical	1A'	trans
431	O3H+	protonated ozone	1A'	Cs
432	O3H+	protonated ozone
433	C2H2O	Oxirene	1A1	C2v
434	CH2CO	Ketene	1A1	C2v
435	CH2CS	Thioketene
436	Be(OH)2	Beryllium hydroxide
437	Be(OH)2	Beryllium hydroxide
438	H2COO	Dioxymethyl radical	2A'	Cs
439	H2COO+	dioxymethyl cation	2A'	Cs
440	HCOOH	Formic acid	1A'	Cs
441	HCOOH	Formic acid
442	BH3CO	Borane carbonyl	1A1	C3v
443	CH2COH+	ketene, protonated
444	HOCHNH	hydroxymethylimine	1A'	CS H all up
445	CHSNH2	thioformamide
446	NHCHSH	Methanimidothioic acid
447	C2H4O	Ethylene oxide	1A1	C2v
448	C2H4O+	ethylene oxide cation
449	CH3CHO	Acetaldehyde	1A'	Cs
450	CH3CHO+	acetaldehyde cation
451	H2COCH2+	Methyl, (methyleneoxoniumyl)-
452	C2H4S	Thiirane	1A1	C2v
453	CH2CHSH	Ethenethiol
454	CH3CHS	Thioacetaldehyde	1A'	C1
455	NH2CHOH+	Formamide, O-protonated
456	CH3SSH	Hydrogen methyl disulfide
457	HSCH2SH	Methanedithiol
458	C2H4OH+	ethylene oxide, protonated	1A'	Cs
459	NH2CH2OH	aminomethanol
460	CH3CH2OH	Ethanol	1A'	Cs
461	CH3OCH3	Dimethyl ether	1A1	C2v
462	CH3CH2SH	ethanethiol	1A'	Cs
463	CH3CH2SH	ethanethiol	1A	C1
464	CH3SCH3	Dimethyl sulfide	1A1	C2v
465	CH3SCH3+	dimethyl sulfide cation
466	CNF	iso cyanogen fluoride	1Σ	C∞v
467	BrCN	Cyanogen bromide	1Σ	C∞v
468	FBO	Boron monofluoride monoxide
469	BeBr2	Beryllium bromide
470	CaBr2	Calcium dibromide
471	BF2	Boron difluoride radical	2A1	C2v
472	FNO	Nitrosyl fluoride	1A'	Cs
473	ClNO	Nitrosyl chloride	1A'	Cs
474	FSN	Thiazyl fluoride	1A'	Cs
475	OPCl	Phosphorus oxychloride
476	CF2	Difluoromethylene	1A1	D∞h
477	CFCl	chlorofluoromethylene	1A'	Cs
478	SiF2	Silicon difluoride	1A1	C2v
479	GeCl2	Germanium dichloride	1A1	C2v
480	CBr2	dibromomethylene	1A1	C2v
481	CBr2	dibromomethylene	3B1	C2v
482	FOO+	Fluorine dioxide cation
483	OClO	Chlorine dioxide	2B1	D∞h
484	OClO-	Chlorine dioxide anion	1A'	Cs
485	BrOO	Bromine dioxide
486	PF2	Phosphorus difluoride
487	PF2+	Phosphorus difluoride cation
488	FClO	chlorosyl fluoride	1A'	Cs
489	ClOF	Chlorine hypofluorite	1A'	Cs
490	SF2	sulfur difluoride	1A1	C2v
491	SeF2	Selenium difluoride
492	SeCl2	Selenium Dichloride
493	SBr2	Sulfur dibromide
494	SeBr2	Selenium dibromide
495	Br3-	tribromide anion
496	SFCl	Sulfur chloride fluoride
497	HCCF	Fluoroacetylene	1Σ	C∞v
498	HCCBr	bromoacetylene	1Σ	C∞v
499	CHF2	difluoromethyl radical	2A	Cs
500	CHF2+	difluoromethyl cation
501	CHFCl	Chlorofluoromethyl radical
502	CHFCl+	Chlorofluoromethyl cation
503	CHCl2+	dichloromethyl cation
504	CHBr2	dibromomethyl radical
505	NHF2	difluoramine
506	NHCl2	dichloroamine
507	CH2F2	Methane, difluoro-	1A1	C2v
508	SiH2F2	difluorosilane
509	CH2Cl2	Methylene chloride	1A1	C2v
510	CH2BrCl	Methane, bromochloro-	1A'	Cs
511	CH2Br2	dibromomethane	1A1	C2v
512	CH3MgBr	Methyl Magnesium Bromide
513	CH2CHF	Ethene, fluoro-	1A'	Cs
514	CH2FOH	fluoromethanol
515	CH2CH2Cl	2-chloroethyl radical	2A'	Cs
516	CHClCH3	1-chloroethyl radical	2A	C1
517	C2H5Br	Ethyl bromide	1A'	Cs
518	C4	Carbon tetramer	3Σg	D∞h
519	C4	Carbon tetramer
520	C4H2+	diacetlyene cation	2Πg	D∞h
521	C4H4	Tetrahedrane
522	C4H6	1-Methylcyclopropene	1A	C1
523	CH2CHCH2CH3	1-Butene	1A	C1
524	CH3CH2CH2CH3	Butane	1Ag	Anti
525	As4	Arsenic tetramer	1A1	Td
526	HCCCN+	Cyanoacetylene cation	2Π	C∞v
527	H2CNCN	cyanamide, methylene
528	HNCCNH	Ethenediimine
529	C2H5CN	ethyl cyanide	1A'	Cs
530	H2NCHCHNH2	diaminoethylene
531	CH7N3	triaminomethane
532	NH2CH2CH2CH3	1-Propanamine	1A'	Cs
533	N(SiH3)3	trisilylamine
534	Na2O2	disodium dioxide
535	K2O2	dipotassium dioxide
536	ONNO	NO dimer	1Ag	trans C2H
537	ONNO	NO dimer	1A1	cis C2V
538	S2N2	Disulfur dinitride	1AG	D2h
539	CS3--	Carbonotrithioate
540	SO3	Sulfur trioxide	1A1'	D3h
541	SO3--	Sulfate dianion
542	S4	Sulfur tetramer
543	S4	Sulfur tetramer
544	S4	Sulfur tetramer
545	HNO3	Nitric acid	1A'	Cs
546	C3H2O	Propadienal
547	C3H2O	Propadienal
548	C2H2O2	Ethanedial	1Ag	C2h
549	CH3NCO	methylisocyante
550	HOCH2CN	cyanomethanol
551	CH3NO2	Methane, nitro-	1A'	Cs
552	H3AlO3	Aluminum hydroxide
553	CH2CHCHO	Acrolein	1A'	Cs
554	CH2CHCHO	Acrolein
555	CH2C(OH)NH2	1-amino vinyl alchohol
556	CH3C(OH)=NH	Ethaninidic acid
557	CH3CSNH2	Ethanethioamide
558	C3H6O	Acetone enol	1A'	Cs
559	CH3CH2CHO	Propanal	1A'	Cs
560	CH3COCH3	Acetone	1A1	C2v
561	CH3SOCH3	Dimethyl sulfoxide	1A'	Cs
562	C3H7OH	1-Propanol
563	Li2F2	Lithium fluoride dimer
564	CF2O	Carbonic difluoride	1A1	C2v
565	CF2O+	Carbonic difluoride cation
566	BF3	Borane, trifluoro-	1A'	D3h
567	BF3+	boron trifluoride cation
568	AlF3	Aluminum trifluoride	1A1'	D3h
569	BClF2	Chlorodifluoroborane
570	BCl3	Borane, trichloro-	1A1'	D3h
571	BCl3+	Boron Trichloride cation
572	GaF3	Gallium trifluoride	1A1'	D3h
573	GaCl3	Gallium trichloride	1A1'	D3h
574	CF2Cl	difluorochloromethyl radical
575	CFCl2	dichlorofluoromethyl radical
576	CBr3	tribromomethyl radical
577	ClO2F	Chloryl fluoride	1A'	Cs
578	SSCl2	Thiothionyl chloride
579	NF3	Nitrogen trifluoride	1A1	C3v
580	NCl3	nitrogen trichloride	1A1	C3v
581	NBr3	Nitrogen Tribromide	1A1	C3v
582	HClO3	Chloric Acid	1A'	Cs
583	HClO3	Chloric Acid	1A	C1
584	CHF3	Methane, trifluoro-	1A1	C3v
585	SiHF3	trifluorosilane
586	CHBrF2	Methane, bromodifluoro-	1A'	Cs
587	CHFClBr	fluorochlorobromomethane	1A	C1
588	CHBrCl2	Methane, bromodichloro-	1A'	Cs
589	CHBr2F	dibromofluoromethane
590	AsF3H+	Arsenic trifluoride, protonated
591	C2H2ClF	1-chloro-1-fluoroethylene	1A'	Cs
592	CHFCHCl	(E)-1-chloro-2-fluoroethene	1A'	Cs
593	CHFCHClz	(Z)-1-Chloro-2-fluoroethene	1A'	Cs
594	CHBrCHBr	Ethene, 1,2-dibromo-, (E)-
595	CHBrCHBr	Ethene, 1,2-dibromo-, (Z)-
596	C2H4F2	1,2-difluoroethane	1Ag	C2H anti
597	C2H4F2	1,2-difluoroethane	1A	C2 gauche
598	CH3CHF2	Ethane, 1,1-difluoro-	1A'	Cs
599	CH2BrCH2Cl	1-bromo-2-chloroethane
600	CH2BrCH2Br	Ethane, 1,2-dibromo-	1Ag	C2h
601	CH2BrCH2Br	Ethane, 1,2-dibromo-	1A	C2
602	CH2CHCH2F	Allyl Fluoride
603	CH2CHCH2F	Allyl Fluoride
604	CH3CHCHF	trans-1-Fluoro-1-propene
605	CH2FCH2OH	2-fluoroethanol
606	CH2FCH2CH3	1-Fluoropropane	1A'	Cs
607	CH2FCH2CH3	1-Fluoropropane
608	CH3CHFCH3	2-Fluoropropane	1A'	Cs
609	CH3CHClCH3	Propane, 2-chloro-	1A'	Cs
610	B5H9	pentaborane9
611	C5H4	pentatetraene
612	C5H6	Propellane	1A1	D3h
613	C5H8	Bicyclo[1.1.1]pentane
614	C3H4N2	2H-Imidazole	1A1	C2v
615	C4H5N	Pyrrole	1A1	C2v
616	C3O2	Carbon suboxide	1ΣG	D∞h
617	B2O3	diboron trioxide
618	B2O3	diboron trioxide
619	CHOOCHO	diformyl ether
620	C3H3NO	Isoxazole	1A'	Cs
621	C3H3NS	Thiazole
622	C4H4O	Furan	1A1	C2
623	CH3COCCH	3-butyn-2-one	1A'	Cs
624	C4H4Se	selenophene
625	HCOOC2H5	Ethyl formate	1A'	Cs
626	C2H6O2S	Dimethyl sulfone	1A1	C2v
627	C4H8S	Thiophene, tetrahydro-	1A	C1
628	C4H10O	Ethoxy ethane	1A1	C2v
629	C4H10O	Methyl propyl ether	1A	C1
630	C(CH3)3SH	2-Propanethiol, 2-methyl-	1A'	Cs
631	C4H9SH	1-Butanethiol
632	CF3Cl	Methane, chlorotrifluoro-	1A1	C3v
633	CF2Cl2	difluorodichloromethane	1A1	C2v
634	CF3Br	Bromotrifluoromethane	1A1	C3v
635	GeF4	Germanium tetrafluoride	1A1	Td
636	CCl4	Carbon tetrachloride	1A1	Td
637	CBrCl2F	bromodichlorofluoromethane
638	CBr2ClF	dibromochlorofluoromethane
639	CBr2Cl2	dibromodichloromethane	1A1	C2v
640	CBr3Cl	tribromochloromethane	1A1	C3v
641	CBr4	Carbon tetrabromide	1A1	Td
642	GeBr4	Germanium tetrabromide
643	SF4	Sulfur tetrafluoride	1A1	C2v
644	SeF4	Selenium tetrafluoride
645	SCl4	Sulfur tetrachloride
646	CH2ClCCCl	1,3-dichloropropyne
647	CHCl2CCH	3,3-dichloropropyne
648	CHCl2CHO	dichloroacetaldehyde
649	CHF2CH2F	Ethane, 1,1,2-trifluoro	1A	C1
650	CHF2CH2F	Ethane, 1,1,2-trifluoro	1A'	Cs
651	CH2CClCHCH2	1,3-Butadiene, 2-chloro-
652	CH2FCH2CH2F	1,3-difluoropropane
653	CH3CCl2CH3	Propane, 2,2-dichloro-	1A1	C2v
654	C2H2N2O	Furazan
655	C6H6	Prismane
656	C6H6	1,2,4,5-Hexatetraene	1Ag	C2h
657	C6H6	Benzene	1A1g	D6h
658	C6H6	Benzvalene	1A1	C2v
659	C6H6	Dewar Benzene
660	N3P3	1,3,5,2,4,6-Triazatriphosphorine
661	C3H2O3	vinylene carbonate
662	C5H6O	2H-Pyran
663	C5H6O	Pentadienal
664	C4H6O2	γ–Butyrolactone	1A	C1
665	C3H6O3	1,3,5-Trioxane	1A1	C1
666	C4H8O2	Ethyl acetate	1A'	Cs
667	C5H10O	3-Pentanone	1A1	C2v
668	C4F2	difluorobutadiyne
669	C2ClF3	Ethene, chlorotrifluoro-
670	C2Br4	tetrabromoethene
671	SiF5-	silicon pentafluoride anion
672	PF5	Phosphorus pentafluoride	1A1'	D3h
673	CHCl2CHCl2	Ethane, 1,1,2,2-tetrachloro-
674	CH2BrCBr3	1,1,1,2-tetrabromo ethane
675	C7H7	cycloheptatrienyl radical	2A2	C2v
676	C7H7+	cycloheptatrienyl cation	1A1'	D7h
677	CH(CN)3	tricyanomethane
678	HN=C=C(CN)2	Dicyanoketenimine
679	C5H4O2	furfural	1A'	OCCO cis
680	C5H4O2	furfural	1A'	OCCO trans
681	C6H12O	Oxepane
682	F2CCCF2	tetrafluoroallene
683	SF6	Sulfur Hexafluoride	1A1G	Oh
684	C8H8	cubane	1A1G	Oh
685	S4N4	Tetrasulfur tetranitride
686	C6H5CHO	benzaldehyde	1A'	Cs
687	C6H4F2	1,4-difluorobenzene	1Ag	D2h
688	C6H4Cl2	1,4-dichlorobenzene
689	C6H5NO	nitrosobenzene	1A'	Cs
690	C3F6	hexafluoropropene
691	C8H18O	1-Octanol
692	C10H10	bullvalene
693	B12H12--	Dodecahydrododecaborate(2-)
694	C13H10	Fluorene
695	C14H14	Bibenzyl	1A	C2

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 anion	h-
5	D2	Deuterium diatomic	d2
6	H2-	hydrogen diatomic anion	h2-
7	H2+	Hydrogen cation	h2+
8	HD	Deuterium hydride	hd
9	H3+	hydrogen trimer cation	h3+
10	He-	Helium atom anion	he-
11	HeH	Helium hydride	heh
12	Li-	Lithium atom anion	li-
13	Na-	Sodium atom anion	na-
14	K-	Potassium atom anion	k-
15	K+	Potassium atom cation	k+
16	Cu-	Copper atom anion	cu-
17	Cu+	Copper atom cation	cu+
18	LiH-	lithium hydride anion	lih-
19	LiH+	lithium hydride cation	lih+
20	NaH	sodium hydride	nah
21	NaH-	sodium hydride anion	nah-
22	NaH+	sodium hydride cation	nah+
23	KH+	Potassium hydrogen cation	kh+
24	CuH	Copper monohydride	cuh
25	Be-	Beryllium atom anion	be-
26	Mg-	Magnesium atom anion	mg-
27	Ca	Calcium atom	ca
28	Ca-	Calcium atom anion	ca-
29	Ca+	Calcium atom cation	ca+
30	Zn-	Zinc atom anion	zn-
31	Zn+	Zinc atom cation	zn+
32	BeH	beryllium monohydride	beh
33	BeH-	berylium monohydride anion	beh-
34	BeH+	beryllium monohydride cation	beh+
35	MgH-	magnesium monohydride anion	mgh-
36	MgH+	magnesium monohydride cation	mgh+
37	CaH	Calcium monohydride	cah
38	CaH+	Calcium monohydride cation	cah+
39	TiH	Titanium monohydride	tih
40	ZnH	Zinc monohydride	znh
41	BeH2	beryllium dihydride	beh2
42	MgH2	magnesium dihydride	mgh2
43	CaH2	Calcium Hydride	cah2
44	ZnH2	Zinc hydride	znh2
45	B-	Boron atom anion	b-
46	Sc	Scandium atom	sc
47	Sc+	Scandium cation	sc+
48	BH	Boron monohydride	bh
49	BH-	boron monohydride anion	bh-
50	BH+	boron monohydride cation	bh+
51	AlH	aluminum monohydride	alh
52	AlH-	aluminum monohydride anion	alh-
53	AlH+	aluminum monohydride cation	alh+
54	ScH	Scandium monohydride	sch
55	ScH+	Scandium monohydride cation	sch+
56	BH2	boron dihydride	bh2
57	BH2-	boron dihydride anion	bh2-
58	BH2+	Boron dihydride cation	bh2+
59	AlH2	aluminum dihydride	alh2
60	AlH2-	aluminum dihydride anion	alh2-
61	AlH2+	aluminum dihydride cation	alh2+
62	BH3	boron trihydride	bh3
63	BH3-	boron trihydride anion	bh3-
64	AlH3	aluminum trihydride	alh3
65	AlH3+	aluminum trihydride cation	alh3+
66	ScH3	Scandium trihydride	sch3
67	GaH3	Gallium trihydride	gah3
68	BH4	borohydride	bh4
69	AlH4-	Aluminum tetrahydride anion	alh4-
70	C-	Carbon atom anion	c-
71	Ti	Titanium atom	ti
72	Ti-	Titanium atom anion	ti-
73	Ti+	Titanium atom cation	ti+
74	Sn	Tin atom	sn
75	Sn+	Tin cation	sn+
76	CH-	methylidyne anion	ch-
77	CH+	Methylidyne cation	ch+
78	SiH-	silicon monohydride anion	sih-
79	SiH+	silicon monohydride cation	sih+
80	GeH+	Germaniun monohyrdide cation	geh+
81	CH2	Methylene	ch2
82	CH2+	methylene cation	ch2+
83	SiH2	silicon dihydride	sih2
84	SiH2-	silicon dihydride anion	sih2-
85	SiH2+	silicon dihydride cation	sih2+
86	GeH2-	germylene anion	geh2-
87	CH3-	methyl anion	ch3-
88	CH3+	methyl cation	ch3+
89	SiH3-	Silyl anion	sih3-
90	CD4	methane-d4	cd4
91	CH2D2	methane-d2	ch2d2
92	CH3D	methane-d	ch3d
93	CH4-	Methane anion	ch4-
94	CH4+	Methane cation	ch4+
95	CHD3	methane-d3	chd3
96	SiH4+	Silane cation	sih4+
97	SnH4	Stannane	snh4
98	N-	Nitrogen atom anion	n-
99	P-	Phosphorus atom anion	p-
100	P+	Phosphorus atom cation	p+
101	V	Vanadium atom	v
102	Sb	Antimony atom	sb
103	NH	Imidogen	nh
104	NH-	Imidogen anion	nh-
105	NH+	imidogen cation	nh+
106	PH-	phosphorus monohydride anion	ph-
107	PH+	phosphorus monohydride cation	ph+
108	AsH+	Arsenic monohydride cation	ash+
109	SbH	Antimony monohydride	sbh
110	ND2	Amidogen-d2	nd2
111	NH2-	amino anion	nh2-
112	PH2	Phosphino radical	ph2
113	PH2-	Phosphino anion	ph2-
114	PH2+	Phosphino cation	ph2+
115	AsH2	Arsenic dihydride	ash2
116	AsH2+	Arsenic dihydride cation	ash2+
117	ND3	Ammonia-d3	nd3
118	NH3-	Ammonia anion	nh3-
119	NH3+	ammonia cation	nh3+
120	SbH3	Stibine	sbh3
121	NH4+	ammonium cation	nh4+
122	PH4+	phosphonium cation	ph4+
123	O-	Oxygen atom anion	o-
124	S-	Sulfur atom anion	s-
125	S+	Sulfur atom cation	s+
126	Cr	Chromium atom	cr
127	Te	Tellurium atom	te
128	Te+	Tellurium atom cation	te+
129	DO	Hydroxyl-d	od
130	OH-	hydroxide anion	oh-
131	DS	Mercapto-d	ds
132	HS	Mercapto radical	hs
133	CrH	Chromium hydride	crh
134	TeH	Telluryl radical	teh
135	D2O	Deuterium oxide	d2o
136	D2S	Hydrogen sulfide-d2	d2s
137	H2S	Hydrogen sulfide	h2s
138	H2S-	Hydrogen sulfide anion	h2s-
139	H2Te	Hydrogen Telluride	h2te
140	H3O+	hydronium cation	h3o+
141	F-	Fluorine atom anion	f-
142	Cl-	Chlorine atom anion	cl-
143	Mn	Manganese atom	mn
144	I	Iodine atom	iodine
145	I-	Iodine atom anion	iodine-
146	I+	Iodine atom cation	iodine+
147	DF	Hydrofluoric acid-d	df
148	DCl	Hydrochloric acid-d	dcl
149	HI	Hydrogen iodide	hi
150	HI+	Hydrogen iodide cation	hi+
151	H2F+	dihydrogen fluoride cation	h2f+
152	H2I+	Iodonium	h2i+
153	Ne-	Neon atom anion	ne-
154	Ar-	Argon atom anion	ar-
155	Ar+	Argon atom cation	ar+
156	Fe	Iron atom	fe
157	Xe	Xenon atom	xe
158	NeH	neon hydrogen	neh
159	NeH+	neon hydrogen cation	neh+
160	XeH+	Xenon, protonated	xeh+
161	H2Ar	H2 Ar dimer	h2ar
162	Co	Cobalt atom	cobalt
163	Ni	Nickel atom	ni
164	Li2	Lithium diatomic	li2
165	Li2-	lithium diatomic anion	li2-
166	Li2+	lithium diatomic cation	li2+
167	NaLi-	lithium sodium anion	lina-
168	NaLi+	lithium sodium cation	lina+
169	LiK	Lithium Potassium	lik
170	Na2+	sodium diatomic cation	na2+
171	NaK	Sodium Potassium	nak
172	NaK+	Sodium Potassium diatomic cation	nak+
173	K2	Potassium diatomic	k2
174	Cu2	Copper diatomic	cu2
175	LiBe	Lithium Beryllium	libe
176	LiMg	Lithium magnesium	limg
177	NaBe	Sodium Beryllium	nabe
178	NaMg	Sodium Magnesium	namg
179	Be2	Beryllium diatomic	be2
180	Be2-	Beryllium diatomic anion	be2-
181	Be2+	Beryllium diatomic cation	be2+
182	BeMg	Beryllium Magnesium	bemg
183	Mg2	Magnesium diatomic	mg2
184	Mg2-	magnesium diatomic anion	mg2-
185	Mg2+	magnesium diatomic cation	mg2+
186	Ca2	Calcium diatomic	ca2
187	LiB	Lithium boride	lib
188	NaAl	Sodium aluminum	naal
189	BeB	Beryllium monoboride	beb
190	B2	Boron diatomic	b2
191	B2-	Boron diatomic anion	b2-
192	B2+	Boron diatomic cation	b2+
193	BAl	Boron Aluminum	bal
194	Al2	Aluminum diatomic	al2
195	Al2-	aluminum diatomic anion	al2-
196	Al2+	aluminum diatomic cation	al2+
197	BGa	Boron Gallium	bga
198	AlGa	Aluminum Gallium	alga
199	Ga2	Gallium diatomic	ga2
200	LiBH4	Lithium borohydride	libh4
201	HBHHBH	Diborane(4) C2V	hbhhbh
202	Al2H6	dialane	al2h6
203	Ga2H6	digallane	ga2h6
204	LiC	Lithium Carbide	lic
205	BeC	Beryllium Carbide	bec
206	BC	boron monocarbide	bc
207	BC-	boron monocarbide anion	bc-
208	BC+	boron monocarbide cation	bc+
209	AlC	Aluminum carbide	alc
210	C2	Carbon diatomic	c2
211	C2-	carbon diatomic anion	c2-
212	C2+	carbon diatomic cation	c2+
213	SiC	silicon monocarbide	sic
214	SiC-	silicon monocarbide anion	sic-
215	SiC+	silicon monocarbide cation	sic+
216	Si2-	silcon diatomic anion	si2-
217	Si2+	silcon diatomic cation	si2+
218	Ge2	Germanium diatomic	ge2
219	C2H	Ethynyl radical	c2h
220	C2H+	Ethynyl cation	c2h+
221	ZnCH2	Zinc methylene	znch2
222	CCH2	vinylidene	vinylidene
223	CuCH3	monomethyl copper	cuch3
224	ZnCH3	Zinc monomethyl	znch3
225	CH2BH	methyleneborane	ch2bh
226	C2H3-	vinyl anion	c2h3-
227	C2H4-	Ethylene anion	c2h4-
228	CH3CH	methylmethylene	ch3ch
229	CH2SiH2	silaethylene	ch2sih2
230	CH3BH2	methylborane	ch3bh2
231	C2H5-	Ethyl anion	c2h5-
232	C2H5+	Ethyl cation	c2h5+
233	C2H6+	ethane cation	c2h6+
234	CH3SiH3	methyl silane	ch3sih3
235	GeH3CH3	methyl germane	geh3ch3
236	C2H7+	Ethane, protonated	c2h7+
237	LiN+	Lithium Nitride cation	lin+
238	BeN	Beryllium mononitride	ben
239	BeN-	Beryllium mononitride anion	ben-
240	BeN+	Beryllium mononitride cation	ben+
241	BN-	boron nitride anion	bn-
242	AlN-	aluminum mononitride anion	aln-
243	AlN+	aluminum mononitride cation	aln+
244	BP	Boron monophosphide	bp
245	AlP	Aluminum monophosphide	alp
246	GaN	Gallium mononitride	gan
247	GaP	Gallium monophosphide	gap
248	BN	boron nitride	bn
249	BN+	boron nitride cation	bn+
250	AlN	Aluminum nitride	aln
251	CN-	cyanide anion	cn-
252	CN+	Cyano cation	cn+
253	CP	Carbon monophosphide	cp
254	CP-	carbon monophosphide anion	cp-
255	CP+	carbon monophosphide cation	cp+
256	SiN	Silicon nitride	sin
257	SiN-	silicon mononitride anion	sin-
258	SiN+	silicon mononitride cation	sin+
259	SiP-	Silicon monophosphide anion	sip-
260	SiP+	Silicon monophosphide cation	sip+
261	TiN	Titanium mononitride	tin
262	N2-	nitrogen diatomic anion	n2-
263	N2+	diatomic nitrogen cation	n2+
264	PN-	phosphorus nitride anion	pn-
265	PN+	phosphorus nitride cation	pn+
266	P2	Phosphorus diatomic	p2
267	P2-	phosphorus diatomic anion	p2-
268	P2+	phosphorus diatomic cation	p2+
269	AsN	Arsenic mononitride	asn
270	AsP	Arsenic monophosphide	asp
271	SbN	Antimony nitride	sbn
272	As2	Arsenic diatomic	as2
273	HNB	hydrogen nitrogen boron	hnb
274	HNC	hydrogen isocyanide	hnc
275	HCN-	Hydrogen cyanide anion	hcn-
276	HCP	Phosphaethyne	hcp
277	NNH	Dinitrogen monohydride	nnh
278	HPO	Hydrogen phosphorus oxide	hpo
279	HPO+	Hydrogen phosphorus oxide cation	hpo+
280	CNH2	Aminomethylidyne radical	cnh2
281	CNH2+	N-protonated hydrogen isocyanide	cnh2+
282	H2CN	Dihydrogen cyanide radical	h2cn
283	H2CN+	hydrocyanonium cation	h2cn+
284	HCNH	methyleneazane	hcnh
285	HCNH+	N-protonated HCN	hcnh+
286	N2H2	(E)-diazene	n2h2
287	N2H2	(Z)-Diazene	n2h2z
288	CH2PH	Phosphaethene	ch3p
289	CH2NH2+	methyleneamine cation	ch2nh2+
290	N2H4+	hydrazine cation	n2h4+
291	P2H4	Diphosphine	p2h4
292	CH3NH2+	methyl amine cation	ch3nh2+
293	CH3PH2	Methyl phosphine	ch3ph2
294	N2H5+	protonated hydrazine	n2h5+
295	CH3NH3+	protonated methylamine	ch3nh3+
296	CH3PH3+	methyl phosphine, protonated	ch3ph3+
297	NH3NH3	Ammonia Dimer	nh3nh3
298	LiO-	lithium oxide anion	lio-
299	LiO+	lithium oxide cation	lio+
300	LiS	Lithium monosulfide	lis
301	LiS+	Lithium sulfide cation	lis+
302	NaO	sodium monoxide	nao
303	NaO-	sodium oxide anion	nao-
304	NaO+	sodium oxide cation	nao+
305	KO	Potassium monoxide	ko
306	KO+	Potassium monoxide cation	ko+
307	NaS	Sodium sulfide	nas
308	CuO	Copper Monoxide	cuo
309	BeO	beryllium oxide	beo
310	BeO-	Beryllium monoxide anion	beo-
311	BeO+	Beryllium monoxide cation	beo+
312	BeS	beryllium sulfide	bes
313	MgO	magnesium oxide	mgo
314	MgO-	magnesium oxide anion	mgo-
315	MgO+	magnesium oxide cation	mgo+
316	MgS	magnesium sulfide	mgs
317	MgS-	magnesium sulfide anion	mgs-
318	MgS+	magnesium sulfide cation	mgs+
319	ZnO	zinc monoxide	zno
320	ZnS	Zinc sulfide	zns
321	BeS-	Beryllium monosulfide anion	bes-
322	BeS+	Beryllium monosulfide cation	bes+
323	BO-	boron monoxide anion	bo-
324	AlO	Aluminum monoxide	alo
325	AlO-	Aluminum monoxide anion	alo-
326	AlO+	aluminum monoxide cation	alo+
327	BS	boron sulfide	bs
328	BS-	boron monosulfide anion	bs-
329	BS+	boron monosulfide cation	bs+
330	AlS	Aluminum sulfide	als
331	AlS-	aluminum monosulfide anion	als-
332	AlS+	aluminum monosulfide cation	als+
333	ScO	Scandium monoxide	sco
334	BO+	boron monoxide cation	bo+
335	CS	carbon monosulfide	cs
336	CS-	carbon monosulfide anion	cs-
337	CS+	carbon monosulfide cation	cs+
338	SiO-	silicon monoxide anion	sio-
339	SiO+	silicon monoxide cation	sio+
340	SiS-	silicon monosulfide anion	sis-
341	SiS+	silicon monosulfide cation	sis+
342	TiO	Titanium monoxide	tio
343	CSe-	Carbon monoselenide anion	cse-
344	CSe+	Carbon monoselenide cation	cse+
345	GeO+	Germanium monoxide cation	geo+
346	GeS	Germanium monosulfide	ges
347	NS	Mononitrogen monosulfide	ns
348	NS-	nitrogen sulfide anion	ns-
349	NS+	nitrogen sulfide cation	ns+
350	PO-	phosphorus monoxide anion	po-
351	PO+	phosphorus monoxide cation	po+
352	PS-	phosphorus monosulfide anion	ps-
353	PS+	phosphorus monosulfide cation	ps+
354	VO	Vanadium monoxide	vo
355	AsO	Arsenic monoxide	aso
356	O2-	oxygen diatomic anion	o2-
357	O2+	diatomic oxygen cation	o2+
358	SO-	sulfur monoxide anion	so-
359	S2-	sulfur diatomic anion	s2-
360	S2+	sulfur diatomic cation	s2+
361	SeO-	selenium monoxide anion	seo-
362	SeO+	selenium monoxide cation	seo+
363	SeS	Selenium monosulfide	ses
364	SeS-	selenium monosulfide anion	ses-
365	SeS+	selenium monosulfide cation	ses+
366	TeO	Tellurium monoxide	teo
367	Se2-	selenium diatomic anion	se2-
368	Se2+	selenium diatomic cation	se2+
369	Te2	Tellurium diatomic	te2
370	MgOH	magnesium hydroxide	mgoh
371	CaOH	Calcium monohydroxide	caoh
372	COH+	Carbon Monoxide, protonated	coh+
373	HCS	Thioformyl radical	hcs
374	HCS-	Thioformyl anion	hcs-
375	HCS+	Thioformyl cation	hcs+
376	HNO-	Nitrosyl hydride anion	hno-
377	NOH	Hydroxyimidogen	noh
378	NOH+	O-protonated nitric oxide	noh+
379	HNS	Sulfur imide	hns
380	HNS-	Sulfur imide anion	hns-
381	HO2	Hydroperoxy radical	ho2
382	HO2-	Hydroperoxy anion	ho2-
383	HO2+	Hydroperoxy cation	ho2+
384	HS2	Thiosulfeno radical	hs2
385	HOCH	hydroxycarbene	hoch
386	H2CS+	thioformaldehyde cation	h2cs+
387	H2NO	nitroxide	h2no
388	H2O2+	Hydrogen peroxide cation	h2o2+
389	H2S2	Disulfane	h2s2
390	H2S2+	hydrogen disulfide cation	h2s2+
391	CH2OH	Hydroxymethyl radical	ch2oh
392	CH3O	Methoxy radical	ch3o
393	CH3O+	Methoxy cation	ch3o+
394	CH3S	thiomethoxy	ch3s
395	H2CSH+	Thioformaldehyde, protonated	h2csh+
396	NH3O	Ammonia Oxide	nh3o
397	H2POH	Phosphinous acid	h2poh
398	H3PO	Phosphine oxide	h3po
399	H3O2+	hydrogen peroxide, protonated	h3o2+
400	CH3OH-	Methyl alcohol anion	ch3oh-
401	CH3SH+	Methanethiol cation	ch3sh+
402	CH3SeH	Methane selenol	ch3seh
403	H2OH2O	water dimer	h2oh2o
404	CH3OH2+	Methanol, protonated	ch3oh2+
405	CH3SH2+	protonated methylsulfide	ch3sh2+
406	H2ONH3	Water Ammonia Dimer	h2onh3
407	LiCl-	lithium chloride anion	licl-
408	LiCl+	lithium chloride cation	licl+
409	NaF	sodium fluoride	naf
410	NaF-	sodium fluoride anion	naf-
411	KF	Potassium Fluoride	kf
412	NaCl	Sodium Chloride	nacl
413	NaCl-	sodium chloride anion	nacl-
414	NaCl+	sodium chloride cation	nacl+
415	KCl	Potassium Chloride	kcl
416	CuF	Copper monofluoride	cuf
417	LiBr-	lithium bromide anion	libr-
418	LiBr+	lithium bromide cation	libr+
419	CuCl	Copper monochloride	cucl
420	NaBr	Sodium Bromide	nabr
421	NaBr-	sodium bromide anion	nabr-
422	NaBr+	sodium bromide cation	nabr+
423	KBr	Potassium Bromide	kbr
424	LiI	Lithium Iodide	lii
425	NaI	Sodium Iodide	nai
426	KI	Potassium Iodide	ki
427	LiF-	lithium fluoride anion	lif-
428	BeF	Beryllium monofluoride	bef
429	BeF-	Beryllium monofluoride anion	bef-
430	BeF+	Beryllium monofluoride cation	bef+
431	BeCl	beryllium monochloride	becl
432	MgF	Magnesium monofluoride	mgf
433	MgF-	magnesium fluoride anion	mgf-
434	MgF+	magnesium fluoride cation	mgf+
435	CaF	Calcium monofluoride	caf
436	MgCl	magnesium monochloride	mgcl
437	MgCl-	magnesium monochloride anion	mgcl-
438	MgCl+	magnesium monochloride cation	mgcl+
439	CaCl	calcium monochloride	cacl
440	TiCl	Titanium Monochloride	ticl
441	ZnF	Zinc monofluoride	znf
442	ZnF-	Zinc monofluoride anion	znf-
443	ZnF+	Zinc monofluoride cation	znf+
444	ZnCl	Zinc monochloride	zncl
445	BeCl-	beryllium monochloride anion	becl-
446	BeCl+	beryllium monochloride cation	becl+
447	BF-	Boron monofluoride anion	bf-
448	BF+	Boron monofluoride cation	bf+
449	AlF-	Aluminum monofluoride anion	alf-
450	AlF+	Aluminum monofluoride cation	alf+
451	BCl	boron monochloride	bcl
452	BCl-	boron monochloride anion	bcl-
453	BCl+	boron monochloride cation	bcl+
454	AlCl	Aluminum monochloride	alcl
455	AlCl-	aluminum monochloride anion	alcl-
456	AlCl+	aluminum monochloride cation	alcl+
457	ScF	Scandium monofluoride	scf
458	BBr	Boron monobromide	bbr
459	GaF+	Gallium monofluoride cation	gaf+
460	GaCl+	Gallium monochloride cation	gacl+
461	AlI	Aluminum monoiodide	ali
462	CF-	carbon monofluoride anion	cf-
463	CF+	carbon monofluoride cation	cf+
464	CCl	carbon monochloride	ccl
465	CCl-	carbon monochloride anion	ccl-
466	CCl+	carbon monochloride cation	ccl+
467	SiF	silicon monofluoride	sif
468	SiF-	silicon monofluoride anion	sif-
469	SiF+	silicon monofluoride cation	sif+
470	SiCl-	silicon monochloride anion	sicl-
471	SiCl+	silicon monochloride cation	sicl+
472	GeF+	Germanium monofluoride cation	gef+
473	NF	nitrogen fluoride	nf
474	NF-	nitrogen monofluorine anion	nf-
475	NF+	nitrogen monofluoirde cation	nf+
476	NCl-	nitrogen monochloride anion	ncl-
477	NCl+	nitrogen monochloride cation	ncl+
478	PF	phosphorus monofluoride	pf
479	PF-	phosphorus monofluoride anion	pf-
480	PF+	phosphorus monofluoride cation	pf+
481	PCl	phosphorus chloride	pcl
482	PCl-	phosphorus monochloride anion	pcl-
483	PCl+	phosphorus monochloride cation	pcl+
484	AsF	Arsenic monofluoride	asf
485	NBr	nitrogen monobromide	nbr
486	AsCl	Arsenic monochloride	ascl
487	SbF	Antimony monofluoride	sbf
488	SbCl	Antimony monochloride	sbcl
489	FO	Oxygen monofluoride	fo
490	FO-	flourine oxide anion	fo-
491	FO+	fluorine monoxide cation	fo+
492	ClO-	chlorine monoxide anion	clo-
493	SF-	sulfur monofluoride anion	sf-
494	SCl	sulfur monochloride	scl
495	SCl-	sulfur monochloride anion	scl-
496	BrO-	Bromine monoxide anion	bro-
497	SeF	Selenium monofluoride	sef
498	SeCl	Selenium monochloride	secl
499	IO	Iodine monoxide	io
500	F2-	flourine diatomic anion	f2-
501	ClF-	clorine monofluoride anion	clf-
502	Cl2-	chlorine diatomic anion	cl2-
503	BrF-	bromine fluoride anion	brf-
504	BrF+	bromine fluoride cation	brf+
505	BrCl-	bromine chloride anion	brcl-
506	BrCl+	bromine chloride cation	brcl+
507	IF	Iodine monofluoride	if
508	ICl	Iodine monochloride	icl
509	IBr	Iodine monobromide	ibr
510	I2	Iodine diatomic	i2
511	I2+	Iodine diatomic cation	i2+
512	HCCl	Chloromethylene	hccl
513	CHBr	bromomethylene	chbr
514	DOCl	Hypochlorous acid-d	docl
515	HOBr	Hypobromous acid	hobr
516	HOBr+	Hypobromous acid cation	hobr+
517	HOI	Hypoiodous acid	hoi
518	FHF	Hydrogen difluoride	fhf
519	FHF-	Hydrogen difluoride anion	fhf-
520	NH2F	monofluoroamine	nh2f
521	H2F2	Hydrogen fluoride dimer	h2f2
522	CD3F	methylfluoride-d3	cd3f
523	CD3Cl	methyl chloride d3	cd3cl
524	SiH3Br	bromosilane	sih3br
525	CH3I	methyl iodide	ch3i
526	SiH3I	Silyl Iodide	sih3i
527	Ne2	Neon diatomic	ne2
528	Ne2+	Neon diatomic cation	ne2+
529	Ar2+	Argon diatomic cation	ar2+
530	Li3	Lithium trimer	li3
531	Li3+	Lithium trimer cation	li3+
532	C3+	carbon trimer cation	c3+
533	C3H3	cyclopropenyl radical	cpr
534	C3H3	Propargyl radical	propargyl
535	C3H3-	Propargyl anion	c3h3-
536	C3H3+	cyclopropenyl cation	cpr+
537	C3H3+	Propargyl cation	c3h3+
538	C3H5+	Allyl cation	allyl+
539	CH3CHCH	1-propenyl radical	ch3chch
540	Zn(CH3)2	dimethyl zinc	dmz
541	C3H7+	cyclopropane, protonated	c3h7+
542	SiH2(CH3)2	dimethylsilane	dms
543	NaCN	Sodium Cyanide	nacn
544	CuCN	Copper cyanide	cucn
545	CN2	3H-Diazirin-3-ylidene	cn2
546	NCN	Cyanoimidogen	ncn
547	N3-	azide anion	n3-
548	N3+	azide cation	n3+
549	HCCN	cyanomethylene	hccn
550	HCNN	diazomethyl radical	hcnn
551	CH2N2	diazirine	ch2n2
552	CH2NN	diazomethane	ch2nn
553	NH2CN	cyanamide	cyanamide
554	CH3CN+	Acetonitrile cation	ch3cn+
555	CH3NC	methyl isocyanide	ch3nc
556	HNCNH2+	diiminomethane, protonated	hncnh2+
557	NCNH3+	Cyanamide, protonated	ncnh3+
558	CH2CHNH	vinylazine	ch2chnh
559	CH3CHN	methylmethaniminyl radical	ch3chn
560	NHCHNH2	aminomethanimine	cn2h4
561	C2H5N	Aziridine	c2h5n
562	CH2CHNH2	aminoethene	aminoethene
563	CH2NCH3	N-methylmethanimine	nmm
564	CH3CHNH	ethanimine	ethanimine
565	NH2BHNH2	diaminoborane	nh2bhnh2
566	C2H5NH+	Protonated Aziridine	c2h5nh+
567	NH2CH2NH2	diaminomethane	nh2ch2nh2
568	CH3NHCH3	Dimethylamine	ch3nhch3
569	CH3PHCH3	dimethylphosphine	ch3phch3
570	NH2CH2NH3+	diaminoethane, protonated	pdam
571	(CH3)2NH2+	dimethylammonium cation	dmam
572	CH3CH2NH3+	ethylamine, protonated	pea
573	Li2O+	dilithium oxide cation	li2o+
574	Li2S	dilithium sulfide	li2s
575	CCO	Dicarbon monoxide	cco
576	CNO-	fulminate	cno-
577	NCO-	cyanate	nco-
578	SCN	thiocyanato radical	scn
579	SCN-	thiocyanide anion	scn-
580	BO2	Boron dioxide	bo2
581	BO2-	Boron dioxide anion	bo2-
582	BO2+	Boron dioxide cation	bo2+
583	N2O-	Nitrous oxide anion	n2o-
584	N2O+	Nitrous oxide cation	n2o+
585	NNS	Nitrogen sulfide	nns
586	PPO	Phosphorus oxide phosphide	ppo
587	CO2-	Carbon dioxide anion	co2-
588	CO2+	Carbon dioxide cation	co2+
589	OCS+	Carbonyl sulfide cation	cos+
590	SiO2	silicon dioxide	sio2
591	CS2-	Carbon disulfide anion	cs2-
592	CS2+	Carbon disulfide cation	cs2+
593	TiO2	Titanium dioxide	tio2
594	SiS2	Silicon disulfide	sis2
595	GeS2	Germanium disulfide	ges2
596	CSe2	Carbon diselenide	cse2
597	SCTe	Carbon sulfide Telluride	scte
598	NO2-	Nitrogen dioxide anion	no2-
599	NO2+	Nitrogen dioxide cation	no2+
600	PO2	Phosphorus dioxide	po2
601	PO2-	Phosphorus dioxide anion	po2-
602	PO2+	Phosphorus dioxide cation	po2+
603	AsO2	Aresenic dioxide	aso2
604	O3	Ozone	o3
605	O3-	Ozone anion	o3-
606	O3+	Ozone cation	o3+
607	SO2-	Sulfur dioxide anion	so2-
608	SO2+	Sulfur dioxide cation	so2+
609	S3-	Sulfur trimer anion	s3-
610	S3+	Sulfur trimer cation	s3+
611	SeO2+	Selenium dioxide cation	seo2+
612	TeO2	Tellurium Dioxide	teo2
613	CS2H+	Carbon disulfide, protonated	cs2h+
614	HNCO	Isocyanic acid	hnco
615	HOCN	cyanic acid	hocn
616	HCO2-	formate anion	hco2-
617	HNNO	nitrosoazane	hnno
618	HNNO+	Nitrous oxide, N-protonated	hnno+
619	NNOH+	Nitrous Oxide, O-protonated	nnoh+
620	HCOO	formate neutral radical	hcoo
621	HOCO+	Hydrocarboxyl cation	hoco+
622	HNO2	Nitrous acid	hno2
623	HNO2+	nitrous acid cation	hno2+
624	SO2H+	protonated sulfur dioxide	so2h+
625	CH2CO+	Ketene cation	ch2co+
626	HCCOH	ethynol	hccoh
627	Mg(OH)2	Magnesium dihydroxide	h2mgo2
628	NH2NO	Nitrosamide	nh2no
629	CH2O2	Dioxirane	diox
630	H2O3	Hydrogen trioxide	h2o3
631	HSSSH	trisulfane	hsssh
632	NaOCH3	Sodium methoxide	naoch3
633	CH2BOH	hydroxy(methylene)borane	ch2boh
634	CH3BO	Borane, methyloxo-	ch3bo
635	CH2CHO	Vinyloxy radical	ch2cho
636	CH3CO	Acetyl radical	ch3co
637	CH3CO-	Acetyl anion	ch3co-
638	CH3CO+	acetyl cation	ch3co+
639	CH2NOH	formaldoxime	ch2noh
640	CH3NO	nitrosomethane	ch3no
641	CHONH2	formamide	formamide
642	CNOH3	1,2-oxaziridine	cnoh3
643	CH2OOH	CH2OOH radical	ch2ooh
644	CH3OO	methylperoxy radical	ch3oo
645	CH3OO-	methylperoxy anion	ch3oo-
646	CH3OO+	methylperoxy cation	ch3oo+
647	CH2CHOH	ethenol	ch2choh
648	H2CONH2+	protonated formamide	h2conh2+
649	NH3CHO+	Formamide, N-Protonated	nh3cho+
650	CH2(OH)2	methanediol	ch2o2h2
651	CH3OOH	Methyl peroxide	ch3ooh
652	H2OH2CO	water formaldehyde dimer	h2oh2co
653	CH2CH2OH	2-hydroxy ethyl radical	ch2ch2oh
654	CH3CH2O	Ethoxy radical	ethoxy
655	CH3CHOH	1-hydroxy-ethyl radical	ch3choh
656	CH3CHOH+	acetaldehyde, protonated	ch3choh+
657	CH3OCH2	methoxymethyl radical	ch3och2
658	CH3SeCH3	dimethylselenide	dmse
659	CH3OHH2O	methanol water dimer	ch3ohh2o
660	H2OCH3OH	water methanol dimer	h2och3oh
661	CuF2	Copper difluoride	cuf2
662	ZnF2	Zinc difluoride	znf2
663	FCN	Cyanogen fluoride	fcn
664	ClCN	chlorocyanogen	clcn
665	ICN	Cyanogen iodide	icn
666	BeF2	Beryllium fluoride	bef2
667	MgF2	Magnesium fluoride	mgf2
668	BeCl2	Beryllium chloride	becl2
669	MgCl2	Magnesium dichloride	mgcl2
670	CaCl2	Calcium Chloride	cacl2
671	ZnCl2	Zinc dichloride	zncl2
672	CaF2	Calcium difluoride	caf2
673	FCO	Carbonyl fluoride	fco
674	FCO+	Carbonyl fluoride cation	fco+
675	ClCO	carbonyl monochloride	clco
676	FNS	Thionitrosyl fluoride	fns
677	BrNO	Nitrosyl bromide	brno
678	INO	Nitrosyl iodide	ino
679	CF2-	Difluoromethylene anion	cf2-
680	CF2+	Difluoromethylene cation	cf2+
681	SiF2+	Silicon difluoride cation	sif2+
682	CCl2	dichloromethylene	ccl2
683	CCl2-	dichloromethylene anion	ccl2-
684	CCl2+	dichloromethylene cation	ccl2+
685	SiCl2	Dichlorosilylene	sicl2
686	GeF2	Germanium difluoride	gef2
687	FOO	Dioxygen monofluoride radical	foo
688	ClOO	chloroperoxy radical	cloo
689	ClOO+	chloroperoxy cation	cloo+
690	OClO+	Chlorine dioxide cation	oclo+
691	ClSO	Sulfur chloride oxide	clso
692	ClS2	Sulfur chloride	cls2
693	OBrO	Bromine dioxide radical	obro
694	NF2	Difluoroamino radical	nf2
695	NF2+	Difluoroamino cation	nf2+
696	F2O	Difluorine monoxide	f2o
697	SF2-	sulfur difluoride anion	sf2-
698	SF2+	sulfur difluoride cation	sf2+
699	Cl2O	Dichlorine monoxide	cl2o
700	SCl2	Sulfur dichloride	scl2
701	BrOCl	Bromine hypochlorite	brocl
702	BrOBr	Bromine oxide	brobr
703	F3-	trifluoride anion	f3-
704	Cl3-	trichloride anion	cl3-
705	I3-	triiodide	i3-
706	HCCF+	fluoroacetylene cation	hccf+
707	HCCCl	Chloroacetylene	hcccl
708	HFCO	formyl fluoride	hfco
709	HFCO+	formyl fluoride cation	hfco+
710	COHCl	Formyl chloride	cohcl
711	COHBr	Formyl bromide	cohbr
712	BHF2	Difluoroborane	bhf2
713	BHCl2	Borane, dichloro-	bhcl2
714	CHCl2	dichloromethyl radical	chcl2
715	HOClO	Chlorous acid	hoclo
716	CH2FCl	fluorochloromethane	ch2fcl
717	CH2BrF	Methane, bromofluoro-	ch2fbr
718	CH2FI	fluoroiodomethane	ch2fi
719	CH2ClI	chloroiodomethane	ch2cli
720	CH2BrI	bromoiodomethane	ch2bri
721	CH2I2	Diiodomethane	ch2i2
722	SiH2Cl2	dichlorosilane	sih2cl2
723	CH2CHF+	fluoroethene cation	ch2chf+
724	C2H3Cl	Ethene, chloro-	ch2chcl
725	C2H3Br	vinyl bromide	c2h3br
726	C2H3I	Vinyl iodide	c2h3i
727	CH3OCl	methyl hypochlorite	ch3ocl
728	C2H5F	fluoroethane	c2h5f
729	CH3CH2Cl	Ethyl chloride	c2h5cl
730	CH3SiFH2	fluoromethylsilane	ch3sifh2
731	C2H5I	Ethyl iodide	c2h5i
732	KrF2	Krypton difluoride	krf2
733	XeF2	Xenon difluoride	xef2
734	B4H10	Tetraborane(10)	b4h10
735	C4+	Carbon tetramer cation	c4+
736	C4H2	Diacetylene	c4h2
737	C2H3CCH	1-Buten-3-yne	c2h3cch
738	C4H4	cyclobutadiene	cbd
739	H2CCCCH2	Butatriene	h2cccch2
740	C4H6	Cyclobutene	c822355
741	C4H6	Methylenecyclopropane	c6142730
742	CH2CCHCH3	1,2-Butadiene	butad12
743	CH2CHCHCH2	1,3-Butadiene	c106990
744	CH3CCCH3	2-Butyne	c503173
745	CHCCH2CH3	1-Butyne	c107006
746	CH3CHCHCH2	methylallyl radical	c4h7
747	C4H8	methylcyclopropane	mcp
748	CH2C(CH3)CH3	1-Propene, 2-methyl-	isobute
749	CH3CHCHCH3	2-Butene, (E)-	bute2e
750	CH3CHCHCH3	2-Butene, (Z)-	bute2z
751	B(CH3)3	trimethylborane	bme3
752	Al(CH3)3	trimethyl aluminum	tma
753	C(CH3)3	Tert-butyl radical	tbutyl
754	CH2CH(CH3)2	Isobutyl radical	isobutyl
755	CH3CHCH2CH3	2-Butyl radical	butyl2
756	CH3CH(CH3)CH3	Isobutane	isobutane
757	SiH(CH3)3	trimethylsilane	trimsi
758	Li3N	trilithium nitride	li3n
759	C2N2	Cyanogen	c2n2
760	C2N2+	Cyanogen cation	c2n2+
761	P4	Phosphorus tetramer	p4
762	HCCCN	Cyanoacetylene	hcccn
763	C3H3N	acrylonitrile	ch2chcn
764	C3H3N+	acrylonitrile cation	ch2chcn+
765	CH3N3	methyl azide	ch3n3
766	NH2CCNH2	Diaminoacetylene	daa
767	NH2CH2CN	Aminoacetonitrile	aan
768	CH3NHN2+	methyl azide, protonated	ch3nhn2+
769	CH5N3	Guanidine	guanidine
770	C4H6	Bicyclo[1.1.0]butane	c157335
771	CH3NNCH3	(Z)-1,2-Dimethyldiazene	dmdiazz
772	CH6N3+	guanidinium	ch6n3+
773	C3H7N	Cyclopropylamine	cpram
774	C3H7N	Azetidine	azet
775	C4H8	cyclobutane	cbutane
776	C2H8N2	Ethylenediamine	ethdiam
777	CH3NHNHCH3	dimethyl hydrazine	dmh
778	CH3CH(NH2)CH3	2-Propanamine	pram2
779	N(CH3)3	Trimethylamine	trimeam
780	P(CH3)3	trimethylphosphine	tmp
781	As(CH3)3	trimethyl arsine	tmas
782	(CH3)3NH+	protonated trimethyl amine	ptma
783	C3H7NH3+	n-propylamine, protonated	c3h7nh2
784	Li2O2	dilithium dioxide	li2o2
785	C3O	Tricarbon monoxide	c3o
786	B2O2	Diboron dioxide	b2o2
787	CO3	Carbon trioxide	co3
788	CO3--	carbonate	co3--
789	NO3	Nitrogen trioxide	no3
790	NO3-	nitrate anion	no3-
791	NO3+	nitrogen trioxide cation	no3+
792	SO3-	Sulfur trioxide anion	so3-
793	SO3+	Sulfur trioxide cation	so3+
794	SeO3	selenium trioxide	seo3
795	TeO3	Tellurium trioxide	teo3
796	HCO3-	bicarbonate anion	hco3-
797	HSO3	Hydroxysulfonyl radical	hso3
798	NH2NO2	nitramide	nh2no2
799	C2H2CO	cyclopropenone	c2h2co
800	HCCCHO	2-propynal	hcccho
801	C2H2O2+	Ethanedial cation	c2h2o2+
802	H2CO3	Carbonic acid	h2co3
803	H2CS3	thiocarbonic acid	h2cs3
804	H2NO3+	Nitric Acid, Protonated	h2no3+
805	H2SO3	Sulfurous acid	h2so3
806	C2H3NO	Nitrosoethylene	c2h3no
807	CH3COO-	acetate anion	ch3coo-
808	CH3ONO	Methyl nitrite	ch3ono
809	NH2COOH	Carbamic acid	nh2cooh
810	H3BO3	Boric acid	h3bo3
811	H3CO3+	carbonic acid, protonated	h3co3+
812	C3H4O	2-Propyn-1-ol	c107197
813	C3H4O	allenol	c9000071
814	C3H4O	Cyclopropanone	cpone
815	C3H4O	Methylketene	c6004440
816	NH2CONH2	Urea	urea
817	NH2CONH2+	Urea cation	urea+
818	NH2CSNH2	Thiourea	thiourea
819	C2H4O2	1,3-dioxetane	c2h4o2
820	CH3COOH	Acetic acid	ch3cooh
821	CH3OCHO	methyl formate	ch3ocho
822	CHOCH2OH	hydroxy acetaldehyde	haa
823	NH2COOH2+	Carbamic acid, O-protonated	nh2cooh2+
824	NH3COOH+	protonated Carbamic acid	nh3cooh+
825	H2OHCOOH	Water formic acid dimer 1	h2ohcooh_10
826	H2OHCOOH	Water formic acid dimer 2	h2ohcooh_11
827	HCOOHH2O	Formic acid water dimer	hcoohh2o
828	HOCH2OOH	hydroxy methyl peroxide	hoch2ooh
829	CH3COCH2	Acetonyl radical	ch3coch2
830	CH3CHNOH	Acetaldoxime	acetaldoxime
831	CH3CONH2	Acetamide	acetamide
832	HCONHCH3	N-methylformamide	nmfa
833	CH5N2O+	urea, N-protonated	ch4n2o+
834	H2NCOHNH2+	urea, protonated	ureah+
835	C2H5OO	ethylperoxy radical	c2h5oo
836	CH3NNCH3	(E)-1,2-Dimethyldiazene	dmdiaze
837	C3H5OH	Cyclopropanol	cproh
838	C3H6O	2-Propen-1-ol	c107186
839	C3H6O	Oxetane	oxetane
840	C3H6O	Propylene oxide	prox
841	CH3COCH3-	acetone anion	ch3coch3-
842	C3H6S	Thietane	thietane
843	C3H6S	Thiirane, methyl-	methiirane
844	CH3CSCH3	Thioacetone	ch3csch3
845	C2H6O2	1,2-Ethanediol	ethdiol
846	CH3OOCH3	dimethylperoxide	dmp
847	CH2SHCH2SH	1,2-Ethanedithiol	ethdisl
848	CH3SSCH3	Disulfide, dimethyl	ch3ssch3
849	CH3COHCH3+	acetone, protonated	acetoneh+
850	HOCH2CH2NH2	monoethanolamine	mea
851	CH3CHOHCH3	Isopropyl alcohol	isoproh
852	CH3OC2H5	Ethane, methoxy-	etome
853	C3H7SH	1-Propanethiol	prsh
854	CH3CHSHCH3	2-Propanethiol	isoprsh
855	CH3SCH2CH3	Ethane, (methylthio)-	etsme
856	H2OCH3OCH3	water dimethylether dimer	h2och3och3
857	Na2F2	Sodium Fluoride Dimer	na2f2
858	Na2Cl2	Disodium dichloride	na2cl2
859	C2F2	difluoroacetylene	c2f2
860	C2Cl2	dichloroacetylene	c2cl2
861	C2Cl2+	dichloroacetylene cation	c2cl2+
862	FNO2	Nitryl fluoride	fno2
863	FONO	Nitrosyl hypofluorite	fono
864	ClNO2	Nitryl chloride	clno2
865	ClONO	chlorine nitrite	clono
866	BrONO	Bromine nitrite	brono
867	N2F2	(Z)-Difluorodiazene	n2f2_z
868	N2F2	Dinitrogen difluoride, (E)-	n2f2_e
869	COFCl	Carbonic chloride fluoride	cofcl
870	CCl2O	Phosgene	cl2co
871	Cl2CS	Thiophosgene	cl2cs
872	COBr2	Carbonic dibromide	cobr2
873	BF3-	Borane, trifluoro- anion	bf3-
874	AlF2Cl	Aluminum chloride difluoride	alclf2
875	ScF3	Scandium trifluoride	ScF3
876	AlFCl2	Aluminum dichloride fluoride	alcl2f
877	AlCl3	Aluminum trichloride	alcl3
878	BBr3	Boron tribromide	bbr3
879	AlBr3	Aluminum Bromide	albr3
880	ClO3	Chlorine trioxide	clo3
881	ClO3-	chlorate anion	clo3-
882	BrO3-	Bromate anion	bro3-
883	CF3	Trifluoromethyl radical	cf3
884	CF3-	Trifluoromethyl anion	cf3-
885	CF3+	Trifluoromethyl cation	cf3+
886	SiF3	Silicon trifluoride radical	sif3
887	SiF3+	Silicon trifluoride cation	sif3+
888	CCl3	Trichloromethyl radical	ccl3
889	CCl3-	Trichloromethyl anion	ccl3-
890	CCl3+	Trichloromethyl cation	ccl3+
891	SiCl3	trichlorosilyl radical	sicl3
892	SiCl3+	trichlorosilyl cation	sicl3+
893	FOOF	Perfluoroperoxide	foof
894	F2SO	Thionyl Fluoride	f2so
895	ClOOCl	Dichlorine dioxide	cloocl
896	FSSF	Difluorodisulfane	fssf
897	S2F2	Thio-thionyl fluoride	s2f2
898	SOCl2	thionyl chloride	socl2
899	SeOCl2	selenium oxychloride	seocl2
900	NF3-	Nitrogen trifluoride anion	nf3-
901	NF3+	Nitrogen trifluoride cation	nf3+
902	PF3	Phosphorus trifluoride	pf3
903	AsF3	Arsenic trifluoride	asf3
904	PCl3	Phosphorus trichloride	pcl3
905	SbF3	Antimony Trifluoride	sbf3
906	AsCl3	Arsenous trichloride	ascl3
907	SbCl3	Antimony Trichloride	sbcl3
908	PBr3	Phosphorus tribromide	pbr3
909	AsBr3	Arsenic tribromide	asbr3
910	NI3	Nitrogen triiodide	ni3
911	PI3	Phosphorus triiodide	pi3
912	ClSSCl	Disulfur dichloride	s2cl2
913	SF3	Sulfur trifluoride	sf3
914	ClF3	Chlorine trifluoride	clf3
915	BrF3	Bromine trifluoride	brf3
916	IF3	iodone trifluoride	if3
917	CHF2Cl	difluorochloromethane	chf2cl
918	CHFCl2	fluorodichloromethane	chfcl2
919	CDCl3	trichloromethane-d	cdcl3
920	CHCl3	Chloroform	chcl3
921	SiHCl3	Trichlorosilane	sihcl3
922	CHF2I	difluoroiodomethane	chf2i
923	CHFClI	fluorochloroiodomethane	chfcli
924	CHCl2I	dichloroiodomethane	chcl2i
925	CHClBr2	Methane, dibromochloro-	chclbr2
926	CHBr3	bromoform	chbr3
927	CHI3	Iodoform	chi3
928	NF3H+	protonated nitrogen trifluoride	nf3h+
929	C2H2F2	Ethene, 1,2-difluoro-, (E)-	c2h2f2e
930	C2H2F2	Ethene, 1,2-difluoro-, (Z)-	c2h2f2z
931	CH2CF2	Ethene, 1,1-difluoro-	ch2cf2
932	CH2CCl2	Ethene, 1,1-dichloro-	ch2ccl2
933	CHClCHCl	Ethene, 1,2-dichloro-, (E)-	chclchcle
934	CHClCHCl	Ethene, 1,2-dichloro-, (Z)-	chclchclz
935	C2H2Br2	1,1-dibromoethene	c2h2br2
936	CH2FCHO	Fluoroacetaldehyde	ch2fcho
937	CH3COF	Acetyl fluoride	ch3cof
938	CH2ClCHO	chloroacetaldehyde	ch2clcho
939	CH3COCl	Acetyl Chloride	ch3cocl
940	CH2FCH2Cl	Ethane, 1-chloro-2-fluoro-	ch2fch2cl
941	CH3CHFCl	Ethane, 1-chloro-1-fluoro-	ch3chfcl
942	CH2ClCH2Cl	Ethane, 1,2-dichloro-	ch2clch2cl
943	CH3CHCl2	Ethane, 1,1-dichloro-	ch3chcl2
944	CH2CFCH3	2-fluoropropene	2fpro
945	C3H5Cl	1-Propene, 3-chloro-	prop1cl3
946	C3H5Cl	1-chloro-1-propene(E)	prop1cl1e
947	C3H5Cl	1-chloro-1-propene(Z)	prop1cl1z
948	CH2ClCH2OH	2-Chloroethanol	ch2clch2oh
949	CH2ClCH2OH2+	2-chloroethanol, protonated	ch2clch2oh2+
950	CH2ClCH2CH3	Propane, 1-chloro-	prcl1
951	CH3CH2CH2Br	n-propyl bromide	prbr
952	CH3CHBrCH3	i-propyl bromide	iprbr
953	C3H9O+	trimethyl oxonium cation	c3h9o+
954	C5H5	cyclopentadienyl radical	c5h5
955	C5H5-	cylopentadienyl anion	c5h5-
956	C5H6	1,3-Cyclopentadiene	c542927
957	C5H6	1-Buten-3-yne, 2-methyl-	c78808
958	C5H6	3-Penten-1-yne, (E)-	c2004695
959	C5H6	3-Penten-1-yne, (Z)-	c1574409
960	C5H6	Bicyclo[2.1.0]pent-2-ene	c5164352
961	C5H6	Cyclopropylacetylene	c6746947
962	C5H7	1,3-pentadienyl radical	pdyl
963	C5H7	cyclopentenyl radical	cpyl
964	C5H8	1,2-Butadiene, 3-methyl-	c598254
965	C5H8	1,2-Pentadiene	c591957
966	C5H8	1,3-Butadiene, 2-methyl-	c78795
967	C5H8	1,3-Pentadiene, (E)-	c2004708
968	C5H8	1,3-Pentadiene, (Z)-	c1574410
969	C5H8	1,4-Pentadiene	c591935
970	C5H8	1-pentyne	a1pentyne
971	C5H8	2,3-Pentadiene	c591968
972	C5H8	Cyclobutane, methylene-	c1120565
973	C5H8	Cyclopentene	c142290
974	C5H8	Ethenylcyclopropane	c693867
975	CH3CCCH2CH3	2-Pentyne	2pentyne
976	C5H10	1-Butene, 2-methyl-	c563462
977	C5H10	2-Butene, 2-methyl-	c513359
978	C5H10	2-Pentene, (E)-	c646048
979	C5H10	2-Pentene, (Z)-	c627203
980	C5H10	Cyclopentane	c287923
981	C5H10	Cyclopropane, 1,1-dimethyl-	c1630940
982	CH2CHCH2CH2CH3	1-pentene	pentene
983	C5H11	2-Methylbut-2-yl radical	c4348350
984	C5H12	Butane, 2-methyl-	buta2
985	C5H12	Pentane	pentane
986	C5H12	Propane, 2,2-dimethyl-	neopentane
987	Si(CH3)4	tetramethylsilane	tms
988	N2O3	Dinitrogen trioxide	n2o3
989	C3H2N2	Malononitrile	c3h2n2
990	CH2N4	1H-Tetrazole	1htz
991	C3H3N2	imidazolyl radical	im
992	C3H3N2-	imidizolyl anion	im-
993	C2H3N3	1H-1,2,4-Triazole	c288880
994	C4H4N	pyrrolide radical	c4h4n
995	C4H4N-	pyrrolide anion	c4h4n-
996	C3H4N2	1H-Imidazole	1himidaz
997	C3H4N2	1H-Pyrazole	1hpyraz
998	C3H4N2	4H-Imidazole	imid4h
999	C4H5N	(E)-2-Butenenitrile	c627269
1000	C4H5N	(Z)-2-Butenenitrile	c1190767
1001	C4H5N	2H-pyrrole	pyrrole2
1002	C4H5N	3H-pyrrole	pyrrole3
1003	C4H5N	Cyclopropanecarbonitrile	c5500210
1004	CH2CHCH2CN	Allylcyanide	ch2chch2cn
1005	C4H6N+	pyrrole, alpha-protonated	appyr
1006	C4H6N+	pyrrole, beta-protonated	bppyr
1007	C4H6N+	pyrrole, protonated	ppyr
1008	C3H6N2	3-Aminopropionitrile	c151188
1009	CH3CH(CH3)CN	Propanenitrile, 2-methyl-	c4h7n
1010	CH3CH2CH2CN	Butanenitrile	c109740
1011	C5H8	Bicyclo[2.1.0]pentane	c185944
1012	C5H8	Spiropentane	c157404
1013	C4H9N	Cyclobutylamine	cbam
1014	C4H9N	Pyrrolidine	pyrrolidine
1015	C3H10N2	1,2-Diaminopropane	diampr12
1016	C(CH3)3NH2	2-Propanamine, 2-methyl-	c75649
1017	C(NH2)H2C(CH3)HCH3	1-Propanamine, 2-methyl-	c78819
1018	C(NH2)H2CH2CH2CH3	1-Butanamine	butam1
1019	CH3C(NH2)HCH2CH3	2-Butanamine	butam2
1020	NH(C2H5)2	diethylamine	dea
1021	NC4H12+	tetramethyl ammonium cation	nc4h12+
1022	C3O2+	Carbon suboxide cation	c3o2+
1023	MgCO3	Magnesium Carbonate	mgco3
1024	BeCO3	Beryllium Carbonate	beco3
1025	CaCO3	Calcium Carbonate	caco3
1026	ONONO	Nitrosyl nitrite	onono
1027	PO4---	phosphate	po4---
1028	SO4--	sulfate	so4--
1029	HOONO2	peroxy nitric acid	hoono2
1030	HSO4-	bisulfate anion	hso4-
1031	C2H2N2S	1,3,4-Thiadiazole	c2h2n2s
1032	C3H2O2	Propiolic acid	c3h2o2
1033	CHOCOOH	oxo acetic acid	oaa
1034	H2SO4	Sulfuric acid	h2so4
1035	H2SeO4	Selenic acid	h2seo4
1036	C3H3NO	Oxazole	oxazole
1037	CH3C(O)OO	acetyl peroxy radical	ch3coo2
1038	CH3NO3	Methyl nitrate	ch3no3
1039	H3PO4	Phosphoric Acid	h3po4
1040	C4H4O	Furan	furan
1041	C4H4O+	Furan cation	furan+
1042	C4H4S	Thiophene	furans
1043	C3H4O2	β–Propiolactone	beta
1044	C3H4O2	2-Propenoic acid	propenoic2
1045	C3H4O2	Methyl glyoxal	megly
1046	C3H4O2	propanedial	propanedial
1047	C3H4O2	propenalol	propenalol
1048	HOCHCCHOH	allenediol	aldiol
1049	C2H4O3	1,2,3-trioxolane	c2h4o3
1050	C2H4O3	trioxolane124	triox
1051	HOCH2COOH	Hydroxyacetic acid	hac
1052	CH2CHCONH2	Acrylamide	c79061
1053	CH3OCH2CN	Methoxyacetonitrile	c1738369
1054	CH5N3S	Hydrazinecarbothioamide	c79196
1055	H2NCH2COOH	Glycine	glycine
1056	CH3SO2NH2	methanesulfonamide	ch3so2nh2
1057	C4H6O	cis-2-butenal	butenal2c
1058	C4H6O	Cyclobutanone	cbutone
1059	C4H6O	Furan, 2,3-dihydro-	furan23h
1060	C4H6O	Furan, 2,5-dihydro-	furan25h
1061	CH2CHOCHCH2	Vinyl ether	vinylether
1062	CHOCHCHCH3	2-Butenal	butenal2
1063	C4H6S	Thiophene, 2,3-dihydro-	thiop23h
1064	C4H6S	Thiophene, 2,5-dihydro-	thiop25h
1065	CH2CHSCHCH2	Divinyl sulfide	divis
1066	C2H6N2O	Urea, methyl-	c598505
1067	C3H6O2	1,3-Dioxolane	dioxolane
1068	CH3CH2COOH	Propanoic Acid	propanoic
1069	CH3COOCH3	methyl acetate	aame
1070	CH3SSSCH3	dimethyl trisulfide	c2h6s3
1071	C3H7NO	dimethylformamide	dmf
1072	C3H7NO	Propanamide	propanam
1073	C2H3OC2H5	Ethene, ethoxy-	c109922
1074	C4H8O	Cyclobutanol	c2919235
1075	C4H8O	Furan, tetrahydro-	thf
1076	CH2C(CH3)OCH3	1-Propene, 2-methoxy-	pre1meo2
1077	CH3COCH2CH3	2-Butanone	buta2one
1078	CHOCH(CH3)CH3	Propanal, 2-methyl-	c78842
1079	CHOCH2CH2CH3	Butanal	butanal
1080	C3H8O2	1,3-Propanediol	c504632
1081	C3H8O2	Hydroperoxide, 1-methylethyl	c3031752
1082	C3H8O2	Methane, dimethoxy-	c109875
1083	C3H8O2	Propylene glycol	c57556
1084	C3H8S2	1,3-Propanedithiol	c109808
1085	C4H10O	1-Butanol	butanol1
1086	C4H10O	1-Propanol, 2-methyl-	c78831
1087	C4H10O	2-Butanol, (.+/-.)-	butanol2
1088	C4H10O	Ethanol, 1,1-dimethyl-	tbuoh
1089	C4H10O	Propane, 2-methoxy-	c598538
1090	C4H10O+	1-Butanol cation	butanol1+
1091	C2H5SC2H5	Diethyl sulfide	etset
1092	CH2(SH)CH(CH3)CH3	1-Propanethiol, 2-methyl-	c513440
1093	CH3C(SCH3)HCH3	Propane, 2-(methylthio)-	mesipr
1094	CH3CH(SH)CH2CH3	2-Butanethiol	butansl2
1095	FNO3	Fluorine nitrate	fno3
1096	ClONO2	Chlorine nitrate	clono2
1097	BrONO2	Bromine nitrate	brono2
1098	TiCl4	Titanium tetrachloride	ticl4
1099	ClO4-	perchlorate anion	clo4-
1100	BF4-	tetrafluoroboron anion	bf4-
1101	ClFO3	Perchloryl fluoride	clfo3
1102	SO2F2	Sulfuryl fluoride	so2f2
1103	SO2Cl2	Sulfuryl chloride	so2cl2
1104	F3NO	Nitrogen trifluoride oxide	f3no
1105	F3PO	Phosphoryl fluoride	pf3o
1106	Cl3PO	Phosphoryl chloride	pcl3o
1107	CF4	Carbon tetrafluoride	cf4
1108	SiF4	Silicon tetrafluoride	sif4
1109	TiF4	Titanium tetrafluoride	tif4
1110	CFCl3	Trichloromonofluoromethane	cfcl3
1111	CCl4+	Carbon tetrachloride cation	ccl4+
1112	CBrClF2	Methane, bromochlorodifluoro-	cbrclf2
1113	SiCl4	Silane, tetrachloro-	sicl4
1114	CF3I	trifluoroiodomethane	cf3i
1115	CBrCl3	Methane, bromotrichloro-	cbrcl3
1116	CBr2F2	Methane, dibromodifluoro-	cbr2f2
1117	GeCl4	Germanium Tetrachloride	gecl4
1118	CCl3I	trichloroiodomethane	ccl3i
1119	CFBr3	fluorotribromomethane	cfbr3
1120	CFClBrI	fluorochlorobromoiodomethane	cfclbri
1121	CF2I2	difluorodiiodomethane	cf2i2
1122	CCl2I2	dichlorodiiodomethane	ccl2i2
1123	SiBr4	Silicon tetrabromide	sibr4
1124	CBr3I	tribromoiododmethane	cbr3i
1125	CI4	tetraiodomethane	ci4
1126	SiI4	silicon tetraiodide	sii4
1127	ClOF3	Chlorine trifluoride oxide	clof3
1128	C2HF3	Trifluoroethylene	c2hf3
1129	C2HF3+	Trifluoroethylene cation	c2hf3+
1130	CHClCCl2	Trichloroethylene	chclccl2
1131	CHBrCF2	1-Bromo-2,2-difluoroethylene	chbrcf2
1132	HClO4	perchloric acid	hclo4
1133	HSO3F	Fluorosulfonic acid	hso3f
1134	CF3OH	trifluoromethanol	cf3oh
1135	CHClCCHCl	1,3-dichloroallene	chclcchcl
1136	PF3CH2	phosphorane, trifluoromethylene-	pf3ch2
1137	CH3CF3	Ethane, 1,1,1-trifluoro-	ch3cf3
1138	CH3CF2Cl	1-Chloro-1,1-Difluoroethane	ch3cf2cl
1139	CH3CFCl2	1,1-Dichloro-1-fluoroethane	ch3cfcl2
1140	CH2ClCHCl2	1,1,2-trichloroethane	ch2clchcl2
1141	CH3CCl3	Ethane, 1,1,1-trichloro-	ch3ccl3
1142	SiCl3CH3	methyltrichlorosilane	sicl3ch3
1143	CH3CBr3	1,1,1-tribromoethane	ch3cbr3
1144	NH3BCl3	Amminetrichloroboron	nh3bcl3
1145	SiH3CCl3	(trichloromethyl)silane	sih3ccl3
1146	C3H5ClO	Oxirane, (chloromethyl)-	c106898
1147	CH3CF2CH3	2,2-difluoropropane	ch3cf2ch3
1148	CH2ClCH2CH2Cl	1,3-dichloropropane	prdicl13
1149	CH2ClCHClCH3	Propane, 1,2-dichloro-	prdicl12
1150	CHCl2CH2CH3	1,1-dichloropropane	prdicl11
1151	SiCl2(CH3)2	dichlorodimethylsilane	sicl2me2
1152	CH2CClCH2CH3	1-Butene, 2-chloro-	bute1cl2
1153	CH2CHCH2CH2Cl	1-Butene, 4-chloro-	bute1cl4
1154	CH2CHCHClCH3	1-Butene, 3-chloro-	bute1cl3
1155	CH2ClCHCHCH3	2-Butene, 1-chloro-	bute2cl1
1156	CH3CClCHCH3	2-Butene, 2-chloro-, (E)-	bute2cl2e
1157	CH3CClCHCH3	2-Butene, 2-chloro-, (Z)-	bute2cl2z
1158	CHClCHCH2CH3	(E)-1-Chloro-1-butene	bute1cl1
1159	CHClCHCH2CH3	(Z)-1-Chloro-1-butene	bute1cl1z
1160	C4H9F	1-fluorobutane	butaf1
1161	CH3CHFCH2CH3	2-fluorobutane	butaf2
1162	CH2ClCH2CH2CH3	Butane, 1-chloro-	butacl1
1163	CH3CCl(CH3)CH3	Propane, 2-chloro-2-methyl-	procl2me2
1164	CH3CHClCH2CH3	Butane, 2-chloro-	butacl2
1165	XeF4	Xenon tetrafluoride	xef4
1166	CF3PH2	phosphine, (trifluoromethyl)-	cf3ph2
1167	NH3BF3	Amminetrifluoroboron	nh3bf3
1168	C6H2	hexatriyne	c6h2
1169	C6H4	(E)-Hexa-1,5-diyne-3-ene	c6h4e
1170	C6H4	(Z)-Hexa-1,5-diyne-3-ene	c6h4z
1171	C6H4	Benzyne	benzyne
1172	C6H5	phenyl	phenyl
1173	C6H5-	phenyl anion	phenyl-
1174	C6H6	2,4-Hexadiyne	hexadiyne
1175	C6H6	3,4-Dimethylenecyclobutene	cb34m
1176	C6H6	Hexa-1,5-diene-3-yne	hdy153
1177	C6H6	Trimethylenecycopropane	tmcp
1178	C6H6+	Benzene cation	c6h6+
1179	C6H7+	benzene, protonated	c6h7+
1180	C6H8	(E)-hexa-1,3,5-triene	c821078
1181	C6H8	(E)-hexa-2,3,4-triene	c59660650
1182	C6H8	(Z)-hexa-1,3,5-triene	hexatri135
1183	C6H8	(Z)-hexa-2,3,4-triene	hetr234c
1184	C6H8	1,3-Cyclohexadiene	cyhexadiene13
1185	C6H8	1,4-Cyclohexadiene	cyhexadiene14
1186	C6H8	3-Methylenecyclopentene	c930267
1187	C6H8	Bicyclo[2.1.1]hex-2-ene	c822413
1188	C6H8	Bicyclo[2.2.0]hex-1(4)-ene	c30830207
1189	C6H8	Bicyclo[3.1.0]hex-2-ene	c694019
1190	C6H10	1,3-Hexadiene, (E)-	hexdi13e
1191	C6H10	1,3-Hexadiene, (Z)-	hexdi13z
1192	C6H10	1,4-Hexadiene, (E)-	hexdi14t
1193	C6H10	1,4-Hexadiene, (Z)-	hexdi14z
1194	C6H10	1,5-Hexadiene	c592427
1195	C6H10	1-Butyne, 3,3-dimethyl-	c917920
1196	C6H10	1-Hexyne	hexyne1
1197	C6H10	2,4-Hexadiene, (E,E)-	hexdi24ee
1198	C6H10	2,4-Hexadiene, (E,Z)-	hexdi24ez
1199	C6H10	2,4-Hexadiene, (Z,Z)-	hexdi24zz
1200	C6H10	2-Hexyne	c764352
1201	C6H10	3-Hexyne	hexyne3
1202	C6H10	cyclohexene	cyclohexene
1203	C6H10	Cyclopentene, 1-methyl-	c693890
1204	C6H10	Cyclopentene, 3-methyl-	c1120623
1205	C6H10	Cyclopentene, 4-methyl-	c1759815
1206	C4H6(CH3)2	1,1-dimethylcyclobutane	dmcb11
1207	C6H12	(1R,2R)-1,2-dimethylcyclobutane	dmcb12t
1208	C6H12	(1r,3r)-1,3-dimethylcyclobutane	dmcb13t
1209	C6H12	(E)-2-Hexene	e2hexene
1210	C6H12	(E)-3-methylpent-2-ene	c616126
1211	C6H12	(E)-hex-3-ene	e3hexene
1212	C6H12	(Z)-3-methylpent-2-ene	c922623
1213	C6H12	(Z)-hex-2-ene	z2hexene
1214	C6H12	(Z)-hex-3-ene	z3hexene
1215	C6H12	2,3-dimethylbut-1-ene	c563780
1216	C6H12	2,3-dimethyl-but-2-ene	tmeet
1217	C6H12	3-methylenepentane	c760214
1218	C6H12	cis-1,2-dimethylcyclobutane	dmcb12c
1219	C6H12	cis-1,3-dimethylcyclobutane	dmcb13c
1220	C6H12	Cyclohexane	cyclohexane
1221	C6H12	Cyclopentane, methyl-	c96377
1222	C6H12	Ethylcyclobutane	c4806615
1223	C6H12	hex-1-ene	hexene1
1224	C6H14	Butane, 2,2-dimethyl-	buta22
1225	C6H14	Butane, 2,3-dimethyl-	buta23
1226	C6H14	Hexane	hexane
1227	C6H14	Pentane, 2-methyl-	penta2
1228	C6H14	Pentane, 3-methyl-	penta3
1229	C4N2	2-Butynedinitrile	c4n2
1230	C4H2N2	Fumaronitrile	c4h2n2
1231	C2H2N4	sym-tetrazine	ttz
1232	C3H3N3	1,3,5-Triazine	triazine135
1233	CH3N5	5-Aminotetrazole	c4418615
1234	C4H4N2	1,3-Diazine	diazine13
1235	C4H4N2	Pyrazine	pyrazine
1236	C4H4N2	Pyridazine	pyridazine
1237	C4H4N2	Succinonitrile	c110612
1238	C2H4N4	1H-Tetrazole, 1-methyl-	c16681779
1239	C2H4N4	1H-Tetrazole, 5-methyl-	c4076362
1240	C2H4N4	2H-Tetrazole, 2-methyl-	c16681780
1241	C5H5N	Bicyclo[1.1.0]butane-1-carbonitrile	bibucn
1242	C5H5N	E-2,4-pentadienenitrile	bdcn
1243	C5H5N	Pyridine	pyridine
1244	B3N3H6	borazine	borazine
1245	C6H6	Fulvene	fulvene
1246	C5H6N+	Pyridinium	c5h6n
1247	C4H6N2	1H-Imidazole, 2-methyl-	c693981
1248	C5H7N	(E)-2-Pentenenitrile	c26294984
1249	C5H7N	(E)-3-Pentenenitrile	c16529661
1250	C5H7N	(Z)-2-Pentenenitrile	c25899507
1251	C5H7N	1H-Pyrrole, 1-methyl-	c96548
1252	C5H7N	Cyclobutanecarbonitrile	c4426113
1253	C5H9N	1,2,3,6-Tetrahydropyridine	c694053
1254	C5H9N	Butanenitrile, 2-methyl-	c18936179
1255	C5H9N	Pentanenitrile	c110598
1256	C5H9N	Propanenitrile, 2,2-dimethyl-	c630182
1257	C6H10	Bicyclo[3.1.0]hexane	c285585
1258	C5H11N	Cyclopentanamine	cypentam
1259	C5H11N	Piperidine	piper
1260	C4H12N2	1,2-Butanediamine	c4426486
1261	C4H12N2	2-Methyl-1,2-propanediamine	c811938
1262	Li2CO3	Lithium Carbonate	li2co3
1263	Na2CO3	Sodium Carbonate	na2co3
1264	C2O4--	oxalate anion	c2o4
1265	MgSO4	Magnesium Sulfate	mgso4
1266	N2O4	Dinitrogen tetroxide	n2o4
1267	C2H2O4	Oxalic Acid	oxalic
1268	C2H3NO3	Oxamic acid	oxamic
1269	C4H4O2	2(5H)-Furanone	furanone
1270	C4H4O2	2-Oxetanone, 4-methylene-	c674828
1271	C2H4N2O2	Oxalamide	oxalamide
1272	C2H4N2S2	Ethanedithioamide	c79403
1273	C2H4CO3	Ethylene carbonate	etco3
1274	C3H4O2S	2H-Thiete-1,1-dioxide	c7285327
1275	C3H4S3	1,3-Dithiolane-2-thione	c822388
1276	C2H4O4	Formic acid dimer	fadimer
1277	C4H5NO	3-Methylisoxazole	isox3m
1278	C4H5NO	Isoxazole, 5-methyl-	c5765446
1279	C4H5NS	4-Methylthiazole	c693958
1280	C2H5NO3	Nitric acid, ethyl ester	c625581
1281	C5H6O	2-methylfuran	furan2m
1282	C5H6O	3-Methylfuran	furan3m
1283	C5H6S	Thiophene, 2-methyl-	c554143
1284	C5H6S	Thiophene, 3-methyl-	c616444
1285	C4H6O2	2,3-Butanedione	c431038
1286	C4H6O2	2-Propenoic acid, methyl ester	c96333
1287	C4H6O2	Crotonic Acid	crot
1288	C4H6OS	2,3-dihydrothiophene-2-ol	c9000117
1289	C4H6OS	2,5-dihydrothiophene-3-ol	c9000093
1290	C4H6OS	4,5-dihydrothiophene-2-ol	c9000106
1291	C4H6OS	4,5-dihydrothiophene-3-ol	c9000082
1292	C4H6OS	Dihydro-2-(3H)-thiophenone	c1003107
1293	C4H6OS	Dihydro-3-(2H)-thiophenone	c1003049
1294	C4H6OS	Vinyl sulfoxide	c1115157
1295	CH6N4S	Carbonothioic dihydrazide	thiacarb
1296	C2H6N2O2	(E)-Azodioxymethane	c37765154
1297	C2H6N2O2	Dimethylnitroamine	c4164287
1298	C3H6S3	1,3,5-Trithiane	c3h6s3
1299	C3H6S3	Carbonotrithioic acid, dimethyl ester	c2314489
1300	C2H6O3S	Sulfurous acid, dimethyl ester	c616422
1301	C4H7NO	2-Pyrrolidinone	c616455
1302	C4H7NO	Ethoxyacetonitrile	etoaccn
1303	C4H7NO	Methacrylamide	c79390
1304	C4H7NO	Oxazole, 4,5-dihydro-2-methyl-	c1120645
1305	HCONH2CN2H4	formamide aminomethanimine dimer	d13
1306	C3H7ONO	Propyl nitrite	prono
1307	CH3CH(CH3)ONO	Isopropyl nitrite	c541424
1308	CH3CH(NH2)COOH	Alanine	alanine
1309	CH3NHCH2COOH	Sarcosine	sarcosine
1310	NH2CH2CH2COOH	β–alanine	betaalanine
1311	NH2COOC2H5	Urethane	urethane
1312	C5H8O	2H-Pyran, 3,4-dihydro-	c110872
1313	C5H8O	Cyclopentanone	c120923
1314	C5H8O	Furan, 2,3-dihydro-5-methyl-	c1487156
1315	C5H8O	Methyl cyclopropyl ketone	c765435
1316	N(CH3)2CONH2	Urea, N,N-dimethyl-	c598947
1317	NH(CH3)CONH(CH3)	Urea, N,N'-dimethyl-	c96311
1318	NH2CONHC2H5	Urea, ethyl-	c625525
1319	C4H8O2	1,3-Dioxane	dioxan13
1320	C4H8O2	1,3-Dioxolane, 2-methyl-	c497267
1321	C4H8O2	1,4-Dioxane	dioxan14
1322	C4H8O2	Ethene, 1,1-dimethoxy-	c922690
1323	C4H8OS	s-Ethyl thioacetate	c625605
1324	C3H8O3	1,2,3-Propanetriol	glycerin
1325	C3H8O2S	(Methylsulfonyl)ethane	c594434
1326	C4H9NO	Butanamide	c541355
1327	C4H9NO	Propanamide, 2-methyl-	c563837
1328	C5H10O	2-Butanone, 3-methyl-	c563804
1329	C5H10O	2H-Pyran, tetrahydro-	c142687
1330	C5H10O	2-methylbutyraldehyde	2meba
1331	C5H10O	2-Pentanone	mpk
1332	C5H10O	Cyclopentanol	c96413
1333	C5H10O	Oxetane, 3,3-dimethyl-	c6921353
1334	C5H10O	Pentanal	pal
1335	C5H10S	2H-Thiopyran, tetrahydro-	c1613510
1336	C5H10S	3-Ethylthio-1-propene	c5296628
1337	C5H10S	Cyclopentanethiol	c1679078
1338	C5H10S	Thiophene, tetrahydro-2-methyl-	c1795091
1339	C5H10S	Thiophene, tetrahydro-3-methyl-	c4740005
1340	C4H10O2	1,1-Dimethoxyethane	c534156
1341	C4H10O2	1,3-Butanediol	budiol13
1342	C4H10O2	1,4-Butanediol	budiol14
1343	C4H10O2	Ethane, 1,2-dimethoxy-	c110714
1344	C4H10OS	Diethyl sulfoxide	c70291
1345	C4H10S2	1,4-Butanedithiol	budisl14
1346	C4H11NO	Diethylhydroxylamine	c3710847
1347	C5H12O	1-Butanol, 2-methyl-	c137326
1348	C5H12O	1-Butanol, 3-methyl-	c123513
1349	C5H12O	1-Pentanol	pentanol1
1350	C5H12O	2-Butanol, 3-methyl-	c598754
1351	C5H12O	2-Pentanol	peol2
1352	C5H12O	3-Pentanol	pentan3ol
1353	C5H12O	Butane, 1-methoxy-	meobu
1354	C5H12O	Propane, 1-ethoxy-	proet
1355	C5H12O	Propane, 2-methoxy-2-methyl-	c1634044
1356	C5H12S	1-Butanethiol, 2-methyl-	c1878188
1357	C5H12S	1-Butanethiol, 3-methyl-	c541311
1358	C5H12S	1-Pentanethiol	c110667
1359	C5H12S	1-Propanethiol, 2,2-dimethyl-	c1679089
1360	C5H12S	2-Butanethiol, 2-methyl-	c1679090
1361	C5H12S	2-Butanethiol, 3-methyl-	c2084186
1362	C5H12S	Butane, 1-(methylthio)-	c628295
1363	C5H12S	Ethyl propyl sulfide	c4110503
1364	C5H12S	Propane, 2-(ethylthio)-	c5145993
1365	C5H12S	Propane, 2-methyl-2-(methylthio)-	c6163640
1366	ClCOClCO	Oxalyl chloride	oxcl
1367	CF3CN	Acetonitrile, trifluoro-	cf3cn
1368	CF3CN+	Acetonitrile, trifluoro- cation	cf3cn+
1369	B2F4	Diboron tetrafluoride	b2f4
1370	B2Cl4	Diboron tetrachloride	b2cl4
1371	C2F4	Tetrafluoroethylene	c2f4
1372	C2F4+	Tetrafluoroethylene cation	c2f4+
1373	CF2CCl2	difluorodichloroethylene	cf2ccl2
1374	CFClCClF	trans-1,2-dichloro-1,2-difluoroethylene	cfclcclf
1375	CFClCFCl	cis-1,2-dichloro-1,2-difluoroethylene	cfclcfcl
1376	C2FCl3	fluorotrichloroethene	c2fcl3
1377	C2Cl4	Tetrachloroethylene	c2cl4
1378	CF3OF	Trifluoromethylhypofluorite	cf3of
1379	SOF4	Sulfur tetrafluoride oxide	sof4
1380	AsF5	Arsenic pentafluoride	asf5
1381	PCl5	Phosphorus pentachloride	pcl5
1382	SF5	Sulfur pentafluoride	sf5
1383	SF5+	pentafluoro sulfur cation	sf5+
1384	SbCl5	Antimony pentachloride	sbcl5
1385	BrF5	bromine pentafluoride	brf5
1386	ClF5	chlorinepentafluoride	clf5
1387	IF5	pentafluoroiodine	if5
1388	CF3CHO	trifluoroacetaldehyde	cf3cho
1389	CCl3CHO	trichloroacetaldehyde	ccl3cho
1390	CHFClCHClF	ethane, 1,2-dichloro-1,2-difluoro-	chfclchclf
1391	CF3CH2F	1,1,1,2-tetrafluoroethane	cf3ch2f
1392	CHF2CHF2	1,1,2,2-tetrafluoroethane	chf2chf2
1393	CF3CH2Cl	2,2,2-Trifluoroethyl chloride	cf3ch2cl
1394	CHFClCHFCl	1,2-dichloro-1,2-difluoroethane RR	chfclchfcl
1395	CH2ClCCl3	1,1,1,2-tetrachloroethane	ch2clccl3
1396	CHCl2CHF2	1,1-dichloro-2,2-difluoroethane	c2h2cl2f2
1397	CF3COOH	trifluoroacetic acid	cf3cooh
1398	C4H3ClO	Furan, 2-chloro	fur2cl
1399	C4H3ClO	Furan,3-chloro	fur3cl
1400	C3H5ClO2	Carbonochloridic acid, ethyl ester	c541413
1401	C3H5Cl3	Propane, 1,2,3-trichloro-	prcl135
1402	C4H8Cl2	1,4-Dichlorobutane	c110565
1403	C4H8Cl2	Butane, 1,2-dichloro-	c616217
1404	C4H8Cl2	Butane, 1,3-dichloro-	c1190223
1405	C4H8Cl2	Butane, 2,3-dichloro-, (r*,r*)-(.+/-.)-	c2211678
1406	C4H8Cl2	Butane, 2,3-dichloro-, (r*,s*)-	c4028562
1407	C4H9ClO	1-Chloro-2-ethoxyethane	c628342
1408	C5H11Cl	Pentane, 1-chloro-	pencl1
1409	C4H8O2	Butanoic acid	bua
1410	C6H5CH2	benzyl radical	benzyl
1411	C6H5CH3	toluene	toluene
1412	C7H8	cycloheptatriene	cht
1413	C7H8	Norbornadiene	norbor
1414	C7H8	Quadricyclane	qucy
1415	C7H12	Norbornane	nor
1416	C7H14	cycloheptane	c7h14
1417	C7H16	2-methylhexane	2mhex
1418	C7H16	3-methylhexane	hex3m
1419	C7H16	heptane	heptane
1420	C6H7N	2-Methylpyridine	mp
1421	C6H5NH2	aniline	aniline
1422	C6H13N	2-Methylpiperidine	pip2m
1423	C6H13N	cyclohexanamine	cham
1424	C6H15N	triethylamine	tea
1425	N2O5	Dinitrogen pentoxide	n2o5
1426	C4H2O3	Maleic Anhydride	malan
1427	C5H4O2	4-Cyclopentene-1,3-dione	cpdio
1428	C6H5O	phenoxy radical	phenoxy
1429	C5H5NO	2(1H)-Pyridinone	c72762006
1430	C5H5NO	2(3H)-Pyridinone	c9000048
1431	C5H5NO	2(5H)-Pyridinone	c9000037
1432	C5H5NO	2-Pyridinol	c109104
1433	C5H5NO	3(2H)-Pyridinone	c9000004
1434	C5H5NO	3(4H)-Pyridinone	c9000026
1435	C5H5NO	3(6H)-Pyridinone	c9000015
1436	C5H5NO	3-Pyridinol	c109002
1437	C5H5NO	4(1H)-Pryidinone	c9000060
1438	C5H5NO	4(3H)-Pryidinone	c9000059
1439	C5H5NO	4-Pyridinol	c626642
1440	C6H5OH	phenol	phenol
1441	C6H6O	2,4-Cyclohexadienone	c24599573
1442	C6H6O	2,5-Cyclohexadienone	c5664335
1443	C6H5SH	Benzenethiol	phsh
1444	HO2CCHNH2CH2OH	Serine	serine
1445	C5H8O2	Acetylacetone	acac
1446	C4H8O2S	Sulfolane	sulfolane
1447	C7H10	Norbornene	norbornene
1448	CH(C2H3)3	trivinyl methane	tvm
1449	C6H10O	cyclohexanone	chexo
1450	C6H12O	hexanal	c6h12o
1451	C3H7OC3H7	di-n-propyl ether	propr
1452	CF3COO-	trifluoro acetate anion	cf3coo-
1453	CF3COF	trifluoroacetyl fluoride	cf3cof
1454	CF3COCl	trifluoroacetyl chloride	cf3cocl
1455	PF6	Hexafluorophosphate neutral	pf6
1456	PF6-	Hexafluorophosphate ion	pf6-
1457	SeF6	Selenium hexafluoride	sef6
1458	SF5Cl	sulfur chloropentafluoride	sf5cl
1459	CF3CHF2	pentafluoroethane	cf3chf2
1460	CF3CHFCl	1,1,1,2-tetrafluorochloroethane	cf3chfcl
1461	CF3CHCl2	1,1-Dichloro-2,2,2-trifluoroethane	cf3chcl2
1462	CHCl2CClF2	Ethane, 1,2,2-trichloro-1,1-difluoro-	chcl2cclf2
1463	CCl3CHCl2	pentachloroethane	ccl3chcl2
1464	C6H5F	Fluorobenzene	bzf
1465	C6H5Cl	chlorobenzene	bzcl
1466	C6H5Br	bromobenzene	bzbr
1467	C8H6	Calicene	calicene
1468	C6H5CCH	phenylacetylene	phac
1469	C8H6	benzocyclobutadiene	bcbd
1470	C8H6	Pentalene	pentalene
1471	C6H5CHCH2	Styrene	styrene
1472	C8H8	cyclooctatetraene	cot
1473	C6H5CH2CH3	Ethylbenzene	etbz
1474	CH3C6H4CH3	meta-xylene	mxylene
1475	CH3C6H4CH3	paraxylene	pxylene
1476	C8H14	Bicyclo[2.2.2]octane	bico222
1477	C8H16	cyclooctane	cyclooct
1478	(CH3)3CC(CH3)3	tetramethylbutane	tmb
1479	C8H18	Octane	c8h18
1480	C6H5CN	phenyl cyanide	phcn
1481	C6H12N2	Triethylenediamine	ted
1482	C4O4--	squarate dianion	c4o4--
1483	S8	Octasulfur	s8
1484	C6H4O2	parabenzoquinone	pbq
1485	C4H4N2O2	Uracil	uracil
1486	C6H5OCH3	Anisole	anisole
1487	C5H9NO2	Proline	proline
1488	C6H12O2	Methyl pivalate	c598981
1489	C6H12O2	Hexanoic acid	hexa
1490	C4F4	tetrafluorcyclobutadiene	c4f4
1491	Al2Cl6	Aluminum, di-μ-chlorotetrachlorodi-	al2cl6
1492	CF3CF2Cl	pentafluorochloroethane	cf3cf2cl
1493	CF2ClCF2Cl	1,2-Dichloro-1,1,2,2-tetrafluoroethane	cf2clcf2cl
1494	CF3CFCl2	1,1-Dichlorotetrafluoroethane	cf3cfcl2
1495	CF2ClCFCl2	Ethane, 1,1,2-trichloro-1,2,2-trifluoro-	cf2clcfcl2
1496	CF3CCl3	1,1,1-trifluoro-2,2,2-trichloroethane	cf3ccl3
1497	C2F6	hexafluoroethane	c2f6
1498	C2Cl6	hexachloroethane	c2cl6
1499	IF7	Iodine heptafluoride	if7
1500	C6H4F2	metadifluorobenzene	mdfb
1501	C6H4F2	orthodifluorobenzene	odfb
1502	C6H4Cl2	1,2-dichlorobenzene	dcb12
1503	C6H4Cl2	1,3-dichlorobenzene	dcb13
1504	C9H8	Indene	indene
1505	C9H8	spiro[4.4]nona-1,3,6,8-tetraene	snt
1506	C9H12	n-propyl benzene	prbz
1507	C9H20	Nonane	nonane
1508	C(CN)4	tetracyanomethane	c5n4
1509	C5H4N4	purine	purine
1510	C8H7N	Indole	indole
1511	C3H3N3O3	cyanuric acid	cyanuric
1512	C6H5NO2	Nitrobenzene	c6h5no2
1513	C6H5COOH	benzoic acid	benzo
1514	CH3COC6H5	acetophenone	acph
1515	C3Cl3N3	1,3,5-Triazine, 2,4,6-trichloro-	c3cl3n3
1516	C6H3F3	Benzene trifluoride 123	bzf3a
1517	C10H8	Azulene	azu
1518	C10H8	naphthalene	naph
1519	C10H16	adamantane	adamantane
1520	C6N4	Tetracyanoethylene	tcne
1521	C6N4-	tetracyanoethylene anion	tcne-
1522	C10H22	Decane	decane
1523	C4F6	perfluorobutadiene	c4f6
1524	SF5CF3	Sulfur, pentafluoro(trifluoromethyl)-	sf5cf3
1525	C3F8	perfluoropropane	c3f8
1526	Fe(CO)5	Iron pentacarbonyl	ipc
1527	Fe(C5H5)2	ferrocene	fecp2
1528	B12H12--	Dodecahydrododecaborate(2-)	b12h12--
1529	C12H8	Acenaphthylene	acenaph
1530	C12H8	biphenylene	biph
1531	C12H10	biphenyl	biphenyl
1532	C12H10	Heptalene	heptalene
1533	C6H12O6	Inositol	inositol
1534	C6F6	hexafluorobenzene	c6f6
1535	S2F10	disulphur decafluoride	s2f10
1536	C14H10	Anthracene	anth
1537	C14H10	Phenanthrene	phenanthrene
1538	C12H10N2	azobenzene	azobenzene
1539	C6H5COC6H5	benzophenone	benzophenone
1540	C16H10	Pyrene	pyrene
1541	C18H12	Tetracene	tetracene
1542	C19H16	Triphenylmethane	tpm
1543	C24H12	Coronene	coronene
1544	C60	Buckminsterfullerene	c60