National Institute of Standards and Technology

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

I	Introduction
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III	Calculated data
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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 MP2=FULL /6-311+G(3df,2p)

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count	Species	Name	State	Conformation
1	H	Hydrogen atom	1S	Kh
2	H2	Hydrogen diatomic	1Σg	D∞h
3	He	Helium atom	1S	Kh
4	He	Helium atom
5	He+	Helium atom cation	2S	Kh
6	HeH+	Helium hydride cation	1Σ	C∞v
7	He2+	helium diatomic cation	2Σu	D∞h
8	Li	Lithium atom	2S	Kh
9	Li+	Lithium atom cation	1S	Kh
10	Na	Sodium atom	2S	Kh
11	Na+	Sodium atom cation	1S	Kh
12	K	Potassium atom	2S	Kh
13	Cu	Copper atom	2S	Kh
14	LiH	Lithium Hydride	1Σ	C∞v
15	KH	Potassium hydride	1Σ	C∞v
16	Be	Beryllium atom	1S	Kh
17	Be+	Beryllium atom cation	2S	Kh
18	Mg	Magnesium atom	1S	Kh
19	Mg+	Magnesium atom cation	2S	Kh
20	Zn	Zinc atom	1S	Kh
21	MgH	magnesium monohydride	2Σ	C∞v
22	ZnH+	Zinc, protonated
23	BeH2+	Beryllium dihydride cation
24	B	Boron atom	2P	Kh
25	B	Boron atom	4P	Kh
26	B+	Boron atom cation	1S	Kh
27	Al	Aluminum atom	2P	Kh
28	Al-	Aluminum atom anion	3P	Kh
29	Al+	Aluminum atom cation	1S	Kh
30	Ga	Gallium atom	2P
31	Ga-	Gallium atom anion	3P	Oh
32	Ga+	Gallium atom cation	1S
33	GaH	Gallium monohydride	1Σ	C∞v
34	GaH+	Gallium monohydride cation	2Σ	C∞v
35	BH3+	boron trihydride cation	2B2	C2v
36	BH3+	boron trihydride cation		C2v
37	AlH3-	aluminum trihydride anion		C3v
38	BH4-	borohydride anion	1A1	Td
39	C	Carbon atom	3P0	Kh
40	C	Carbon atom	3P1	Kh
41	C+	Carbon atom cation	2P	Kh
42	Si	Silicon atom	3P	Kh
43	Si	Silicon atom	1S	Kh
44	Si-	Silicon atom anion	4S	Kh
45	Si+	Silicon atom cation	2P	Kh
46	Ge	Germanium atom	3P	Kh
47	Ge-	Germanium anion	4S	Kh
48	Ge+	Germanium cation	2P	Kh
49	CH	Methylidyne	2Π1/2	C∞v
50	SiH	Silylidyne	2Π	C∞v
51	GeH	germylidene	2Π	C∞v
52	CH2-	methylene anion	2B1	C2v
53	GeH2	germylene	1A1	C2v
54	CH3	Methyl radical	2A1	D3h
55	SiH3	Silyl radical	2A1	C3v
56	SiH3+	Silyl cation	1A1'	D3h
57	GeH3	Germyl radical	2A1	C3v
58	GeH3+	germyl cation	1A1'	D3h
59	CH4	Methane	1A1	Td
60	SiH2D2	silane-d2
61	SiH4	Silane	1A1	Td
62	GeH4	Germane	1A1	Td
63	SiH5+	Silane, protonated
64	N	Nitrogen atom	4S	Kh
65	N	Nitrogen atom	2D	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	LiSe	Lithium monoselenide
208	CaO	Calcium monoxide	1Σ	C∞v
209	CaS	Calcium sulfide	1Σ	C∞v
210	BO	boron monoxide	2Σ	C∞v
211	GaO	Gallium monoxide	2Σ	C∞v
212	GaS	Gallium monosulfide
213	CO	Carbon monoxide	1Σ	C∞v
214	CO-	carbon monoxide anion	2Π	C∞v
215	CO+	carbon monoxide cation	2Σ	C∞v
216	SiO	Silicon monoxide	1Σ	C∞v
217	SiS	silicon monosulfide	1Σ	C∞v
218	CSe	Carbon monoselenide	1Σ	C∞v
219	GeO	Germanium monoxide	1Σ	C∞v
220	SiSe	Silicon Monoselenide
221	SiSe+	Silicon Monoselenide cation
222	GeSe	Germanium monoselenide
223	NO	Nitric oxide	2Π	C∞v
224	NO-	nitric oxide anion	3Σ	C∞v
225	NO+	nitric oxide cation	1Σ	C∞v
226	PO	Phosphorus monoxide	2Π	C∞v
227	PS	phosphorus sulfide	2Σ	C∞v
228	NSe	Nitrogen monoselenide	2Π	C∞v
229	AsS	Arsenic monosulfide	2Π	C∞v
230	PSe	Phosphorus monoselenide	2Π	C∞v
231	AsSe	Arsenic monoselenide	2Π	C∞v
232	O2	Oxygen diatomic	3Σg	D∞h
233	O2--	dioxygen dianion
234	SO	Sulfur monoxide	3Σ	C∞v
235	SO	Sulfur monoxide	1Σ	C∞v
236	SO+	sulfur monoxide cation	2Π	C∞v
237	S2	Sulfur diatomic	3Σg	D∞h
238	SeO	Selenium monoxide	3Σ	C∞v
239	Se2	Selenium diatomic	3Σg	D∞h
240	LiOH	lithium hydroxide	1Σ	C∞v
241	KOH	Potassium hydroxide	1Σ	C∞v
242	BeOH	beryllium monohydroxide	2A'	Cs
243	HBO	Boron hydride oxide	1Σ	C∞v
244	HBS	hydrogen boron sulfide	1Σ	C∞v
245	COH	Hydroxymethylidyne
246	HCO	Formyl radical	2A'	Cs
247	HCO-	formyl anion	1A'	Cs
248	HCO+	Formyl cation	1Σ	C∞v
249	HNO	Nitrosyl hydride	1A'	Cs
250	HNO+	Nitrosyl hydride cation	2A'	Cs
251	HSO+	Sulfur Monoxide, S-protonated
252	SOH	Sulfur Hydroxide
253	SOH+	Sulfur Monoxide, protonated
254	H2CO	Formaldehyde	1A1	C2v
255	H2CO-	formaldehyde anion	2A'	Cs
256	H2CO-	formaldehyde anion
257	H2CO+	formaldehyde cation	2B2	C2v
258	H2CS	Thioformaldehyde	1A1	C2v
259	H2CS-	thioformaldehyde anion
260	H2CS-	thioformaldehyde anion
261	H2CSe	Selenoformaldehyde
262	H2O2	Hydrogen peroxide	1A	C2
263	H2O2	Hydrogen peroxide	1Ag	C2h
264	H2OO	water oxide
265	HOSH	hydrogen thioperoxide
266	H2Se2	hydrogen diselenide
267	CH2OH+	hydroxymethyl cation	1A'	Cs
268	CH3O-	methoxy anion	1A1	C3v
269	NH2OH	hydroxylamine	1A'	Cs
270	NH2OH+	Hydroxylamine cation
271	NH2SH	Thiohydroxylamine
272	NH2SH	Thiohydroxylamine
273	NH3S	sulfidoazane
274	CH3OH	Methyl alcohol	1A'	Cs
275	CH3OH+	Methyl alcohol cation	2A"	Cs
276	CH3SH	Methanethiol	1A'	Cs
277	SiH3OH	silanol
278	NH2OH2+	protonated hydroxylamine
279	NH3OH+	N-protonated hydroxylamine
280	H5O2+	Dihydroxonium ion	1A	C2
281	LiF	lithium fluoride	1Σ	C∞v
282	LiCl	lithium chloride	1Σ	C∞v
283	NaF+	sodium fluoride cation	2Σ	C∞v
284	LiBr	Lithium Bromide	1Σ	C∞v
285	LiF+	lithium fluoride cation	2Π	C∞v
286	CaBr	Calcium monobromide
287	BF	Boron monofluoride	1Σ	C∞v
288	AlF	Aluminum monofluoride	1Σ+	C∞v
289	GaF	Gallium monofluoride	1Σ	C∞v
290	AlBr	Aluminum monobromide
291	GaCl	Gallium monochloride	1ΣG	C∞v
292	GaBr	Gallium monobromide
293	CF	Fluoromethylidyne	2Π	C∞v
294	SiCl	Clorosilylidyne	2Π	C∞v
295	CBr	Carbon monobromide	2Π	C∞v
296	GeF	Germanium monofluoride	2Π	C∞v
297	GeCl	Germanium monochloride	2Π	C∞v
298	GeCl+	Germanium monochloride cation
299	SiBr	Silicon monobromide	2Π	C∞v
300	SiBr+	Silicon monobromide cation
301	NCl	nitrogen monochloride	3Σ	C∞v
302	PBr	Phosphorus monobromide
303	ClO	Monochlorine monoxide	2Π	C∞v
304	ClO+	chlorine monoxide cation	3Σ	C∞v
305	SF	Monosulfur monofluoride	2Π	C∞v
306	SF+	sulfur monofluoride cation	3Σ	C∞v
307	SCl+	sulfur monochloride cation	3Σg	C∞v
308	BrO	Bromine monoxide	2Π	C∞v
309	BrO+	Bromine monoxide cation
310	SBr	Sulfur monobromide radical
311	SBr+	Sulfur monobromide cation
312	SeBr	Selenium monobromide
313	BrCl	Bromine monochloride	1Σ	C∞v
314	F2	Fluorine diatomic	1Σg	D∞h
315	F2+	flourine diatomic cation	2Πg	D∞h
316	ClF	Chlorine monofluoride	1Σ+	C∞v
317	ClF+	clorine monofluoride cation	2Π	C∞v
318	Cl2	Chlorine diatomic	1Σg	D∞h
319	Cl2+	chlorine diatomic cation	2Πg	D∞h
320	BrF	Bromine monofluoride	1Σ	C∞v
321	Br2	Bromine diatomic	1Σg	D∞h
322	Br2-	bromine diatomic anion	2Σu	D∞h
323	Br2+	bromine diatomic cation	2Πg	D∞h
324	HCF	Fluoromethylene	1A'	Cs
325	HCF	Fluoromethylene	3A"	Cs
326	HSiF	fluorosilylene
327	HSiCl	Chlorosilylene
328	HSiBr	monobromosilylene
329	HOF	Hypofluorous acid	1A'	Cs
330	HOCl	hypochlorous acid	1A'	Cs
331	HOCl+	hypochlorous acid cation
332	F2H+	Fluorine, protonated	1A'	Cs
333	ClFH+	Chlorine fluoride, F-protonated
334	FClH+	Chlorine fluoride, Cl-protonated
335	Cl2H+	Chlorine, protonated	1A'	Cs
336	CH2Br	bromomethyl radical
337	CH2F	fluoromethyl radical	2A	Cs
338	CH2F+	fluoromethyl cation
339	CH2Cl+	chloromethyl cation
340	CH2Cl	chloromethyl radical	2A'	Cs
341	CH2Cl	chloromethyl radical	2B1	C2v
342	NH2Cl	chloramine	1A'	Cs
343	CH3F+	methyl fluoride cation
344	CH3F	Methyl fluoride	1A1	C3v
345	CH3Cl	Methyl chloride	1A1	C3v
346	CH3Cl+	Methyl chloride cation
347	SiH3F	monofluorosilane	1A1	C3v
348	SiH3Cl	chlorosilane	1A1	C1
349	CH3Br	methyl bromide	1A1	C3v
350	GeH3F	monofluorogermane
351	GeH3Cl	monochlorogermane
352	NH3Cl+	protonated monochloroammonia
353	CH3ClH+	methyl chloride, protonated
354	NH4Cl	Ammonium chloride
355	LiNe+	Lithium Neon cation
356	Ar2	Argon diatomic	1Sg	D∞h
357	C3	carbon trimer	1Σg	D∞h
358	C3	carbon trimer	1A1	C2v
359	SiC2	Silicon dicarbide
360	C3H4	cyclopropene	1A1	C2v
361	CH2CCH2	allene	1A1	D2d
362	CH3CCH	propyne	1A'	C3v
363	C3H5	Allyl radical	2A2	C2v
364	C3H6	Cyclopropane	1A1'	D3h
365	CH2CHCH3	Propene	1A'	Cs
366	C3H7	n-Propyl radical	2A"	C1
367	CH3CHCH3	Isopropyl radical	2A	C2
368	CH3CHCH3+	Isopropyl cation	1A	C2
369	C3H8	Propane	1A1	C2v
370	Si3H8	trisilane
371	LiCN	lithium cyanide	1Σ	C*V LiCN
372	KCN	Potassium cyanide	1Σ	C∞v
373	KCN	Potassium cyanide	1Σ	C∞v
374	KCN	Potassium cyanide	1A'	Cs
375	ZnCN	Zinc monocyanide	2Σ	C∞v
376	ZnNC	Zinc isocyanide	2Σ	C∞v
377	AlCN	Aluminum monocyanide
378	AlNC	Aluminum isocyanide
379	CNN	Diazocarbene
380	N3	azide radical	2Πg	D∞h
381	HN3	hydrogen azide	1A'	Cs
382	HN3+	Hydrazoic acid cation
383	HNCNH	diiminomethane	1A	C2
384	HNNNH+	1,2-Triazadienium
385	NH2NN+	hydrazoic acid, protonated
386	CH3CN	Acetonitrile	1A1	C3v
387	CH3CN-	acetonitrile anion	2E	C3v
388	CH3CN-	acetonitrile anion	2A'	Cs
389	CHNCH2	2H-Azirine
390	CHNHCH	1H-Azirine
391	H2CCNH	Ethenimine
392	H2CNCH	methyleneaminomethylene
393	HCCNH2	Ethynamine
394	HCNCH2+	2H-Azirine cation
395	NH2CNH+	cyanamide, cn protonated
396	NH3CN+	cyanamide, amine protonated
397	C2H6N+	aziridine, protonated	1A1	C2v
398	CH3CH2NH2	Ethylamine
399	Li2O	dilithium oxide	1Σg	D∞h
400	Na2O	disodium monoxide	1Σg	Linear
401	Na2O	disodium monoxide	1A1	C2v
402	Na2S	Sodium sulfide
403	Na2S	Sodium sulfide
404	LiO2	Lithium dioxide
405	NaO2	Sodium superoxide
406	NCO	isocyanato radical	2Π	C∞v
407	N2O	Nitrous oxide	1Σ	C∞v
408	CO2	Carbon dioxide	1Σg	D∞h
409	OCS	Carbonyl sulfide	1Σ	C∞v
410	CS2	Carbon disulfide	1Σg	D∞h
411	GeO2	Germanium dioxide	1Σg	D∞h
412	OCSe	Carbonyl selenide	1Σ	C∞v
413	SCSe	Carbon sulfide selenide
414	NO2	Nitrogen dioxide	2A1	C2v
415	NSO	sulfinyl amidogen
416	SNO	Nitrogen oxide sulfide
417	SO2	Sulfur dioxide	1A1	C2v
418	SSO	Disulfur monoxide	1A'	Cs
419	S3	Sulfur trimer	1A1	C2v
420	S3	Sulfur trimer
421	SeO2	Selenium dioxide	1A1	C2v
422	HCCO	ketenyl radical	2Π	C∞v
423	HCCO	ketenyl radical	2A"	Cs
424	HCNO	fulminic acid	1Σ	C∞v
425	HNCS	Isothiocyanic acid
426	HSCN	thiocyanic acid	1A'	Cs
427	HOCO	Hydrocarboxyl radical	1A'	cis
428	HOCO	Hydrocarboxyl radical	1A'	trans
429	O3H+	protonated ozone	1A'	Cs
430	O3H+	protonated ozone
431	C2H2O	Oxirene	1A1	C2v
432	CH2CO	Ketene	1A1	C2v
433	CH2CS	Thioketene
434	Be(OH)2	Beryllium hydroxide
435	Be(OH)2	Beryllium hydroxide
436	H2COO	Dioxymethyl radical	2A'	Cs
437	H2COO+	dioxymethyl cation	2A'	Cs
438	HCOOH	Formic acid	1A'	Cs
439	HCOOH	Formic acid
440	BH3CO	Borane carbonyl	1A1	C3v
441	CH2COH+	ketene, protonated
442	HOCHNH	hydroxymethylimine	1A'	CS H all up
443	CHSNH2	thioformamide
444	NHCHSH	Methanimidothioic acid
445	C2H4O	Ethylene oxide	1A1	C2v
446	C2H4O+	ethylene oxide cation
447	CH3CHO	Acetaldehyde	1A'	Cs
448	CH3CHO+	acetaldehyde cation
449	H2COCH2+	Methyl, (methyleneoxoniumyl)-
450	C2H4S	Thiirane	1A1	C2v
451	CH2CHSH	Ethenethiol
452	CH3CHS	Thioacetaldehyde	1A'	C1
453	NH2CHOH+	Formamide, O-protonated
454	CH3SSH	Hydrogen methyl disulfide
455	HSCH2SH	Methanedithiol
456	C2H4OH+	ethylene oxide, protonated	1A'	Cs
457	NH2CH2OH	aminomethanol
458	CH3CH2OH	Ethanol	1A'	Cs
459	CH3OCH3	Dimethyl ether	1A1	C2v
460	CH3CH2SH	ethanethiol	1A'	Cs
461	CH3CH2SH	ethanethiol	1A	C1
462	CH3SCH3	Dimethyl sulfide	1A1	C2v
463	CH3SCH3+	dimethyl sulfide cation
464	CNF	iso cyanogen fluoride	1Σ	C∞v
465	BrCN	Cyanogen bromide	1Σ	C∞v
466	FBO	Boron monofluoride monoxide
467	BeBr2	Beryllium bromide
468	CaBr2	Calcium dibromide
469	BF2	Boron difluoride radical	2A1	C2v
470	FNO	Nitrosyl fluoride	1A'	Cs
471	ClNO	Nitrosyl chloride	1A'	Cs
472	FSN	Thiazyl fluoride	1A'	Cs
473	OPCl	Phosphorus oxychloride
474	CF2	Difluoromethylene	1A1	D∞h
475	CFCl	chlorofluoromethylene	1A'	Cs
476	SiF2	Silicon difluoride	1A1	C2v
477	GeCl2	Germanium dichloride	1A1	C2v
478	CBr2	dibromomethylene	1A1	C2v
479	CBr2	dibromomethylene	3B1	C2v
480	FOO+	Fluorine dioxide cation
481	OClO	Chlorine dioxide	2B1	D∞h
482	OClO-	Chlorine dioxide anion	1A'	Cs
483	BrOO	Bromine dioxide
484	PF2	Phosphorus difluoride
485	PF2+	Phosphorus difluoride cation
486	FClO	chlorosyl fluoride	1A'	Cs
487	ClOF	Chlorine hypofluorite	1A'	Cs
488	SF2	sulfur difluoride	1A1	C2v
489	SeF2	Selenium difluoride
490	SeCl2	Selenium Dichloride
491	SBr2	Sulfur dibromide
492	SeBr2	Selenium dibromide
493	Br3-	tribromide anion
494	SFCl	Sulfur chloride fluoride
495	HCCF	Fluoroacetylene	1Σ	C∞v
496	HCCBr	bromoacetylene	1Σ	C∞v
497	CHF2	difluoromethyl radical	2A	Cs
498	CHF2+	difluoromethyl cation
499	CHFCl	Chlorofluoromethyl radical
500	CHFCl+	Chlorofluoromethyl cation
501	CHCl2+	dichloromethyl cation
502	CHBr2	dibromomethyl radical
503	NHF2	difluoramine
504	NHCl2	dichloroamine
505	CH2F2	Methane, difluoro-	1A1	C2v
506	SiH2F2	difluorosilane
507	CH2Cl2	Methylene chloride	1A1	C2v
508	CH2BrCl	Methane, bromochloro-	1A'	Cs
509	CH2Br2	dibromomethane	1A1	C2v
510	CH3MgBr	Methyl Magnesium Bromide
511	CH2CHF	Ethene, fluoro-	1A'	Cs
512	CH2FOH	fluoromethanol
513	CH2CH2Cl	2-chloroethyl radical	2A'	Cs
514	CHClCH3	1-chloroethyl radical	2A	C1
515	C2H5Br	Ethyl bromide	1A'	Cs
516	C4	Carbon tetramer	3Σg	D∞h
517	C4	Carbon tetramer
518	C4H2+	diacetlyene cation	2Πg	D∞h
519	C4H4	Tetrahedrane
520	C4H6	1-Methylcyclopropene	1A	C1
521	CH2CHCH2CH3	1-Butene	1A	C1
522	CH3CH2CH2CH3	Butane	1Ag	Anti
523	As4	Arsenic tetramer	1A1	Td
524	HCCCN+	Cyanoacetylene cation	2Π	C∞v
525	H2CNCN	cyanamide, methylene
526	HNCCNH	Ethenediimine
527	C2H5CN	ethyl cyanide	1A'	Cs
528	H2NCHCHNH2	diaminoethylene
529	CH7N3	triaminomethane
530	NH2CH2CH2CH3	1-Propanamine	1A'	Cs
531	N(SiH3)3	trisilylamine
532	Na2O2	disodium dioxide
533	K2O2	dipotassium dioxide
534	ONNO	NO dimer	1Ag	trans C2H
535	ONNO	NO dimer	1A1	cis C2V
536	S2N2	Disulfur dinitride	1AG	D2h
537	CS3--	Carbonotrithioate
538	SO3	Sulfur trioxide	1A1'	D3h
539	SO3--	Sulfate dianion
540	S4	Sulfur tetramer
541	S4	Sulfur tetramer
542	S4	Sulfur tetramer
543	HNO3	Nitric acid	1A'	Cs
544	C3H2O	Propadienal
545	C3H2O	Propadienal
546	C2H2O2	Ethanedial	1Ag	C2h
547	CH3NCO	methylisocyante
548	HOCH2CN	cyanomethanol
549	CH3NO2	Methane, nitro-	1A'	Cs
550	H3AlO3	Aluminum hydroxide
551	CH2CHCHO	Acrolein	1A'	Cs
552	CH2CHCHO	Acrolein
553	CH2C(OH)NH2	1-amino vinyl alchohol
554	CH3C(OH)=NH	Ethaninidic acid
555	CH3CSNH2	Ethanethioamide
556	C3H6O	Acetone enol	1A'	Cs
557	CH3CH2CHO	Propanal	1A'	Cs
558	CH3COCH3	Acetone	1A1	C2v
559	CH3SOCH3	Dimethyl sulfoxide	1A'	Cs
560	C3H7OH	1-Propanol
561	Li2F2	Lithium fluoride dimer
562	CF2O	Carbonic difluoride	1A1	C2v
563	CF2O+	Carbonic difluoride cation
564	BF3	Borane, trifluoro-	1A'	D3h
565	BF3+	boron trifluoride cation
566	AlF3	Aluminum trifluoride	1A1'	D3h
567	BClF2	Chlorodifluoroborane
568	BCl3	Borane, trichloro-	1A1'	D3h
569	BCl3+	Boron Trichloride cation
570	GaF3	Gallium trifluoride	1A1'	D3h
571	GaCl3	Gallium trichloride	1A1'	D3h
572	CF2Cl	difluorochloromethyl radical
573	CFCl2	dichlorofluoromethyl radical
574	CBr3	tribromomethyl radical
575	ClO2F	Chloryl fluoride	1A'	Cs
576	SSCl2	Thiothionyl chloride
577	NF3	Nitrogen trifluoride	1A1	C3v
578	NCl3	nitrogen trichloride	1A1	C3v
579	NBr3	Nitrogen Tribromide	1A1	C3v
580	HClO3	Chloric Acid	1A'	Cs
581	HClO3	Chloric Acid	1A	C1
582	CHF3	Methane, trifluoro-	1A1	C3v
583	SiHF3	trifluorosilane
584	CHBrF2	Methane, bromodifluoro-	1A'	Cs
585	CHFClBr	fluorochlorobromomethane	1A	C1
586	CHBrCl2	Methane, bromodichloro-	1A'	Cs
587	CHBr2F	dibromofluoromethane
588	AsF3H+	Arsenic trifluoride, protonated
589	C2H2ClF	1-chloro-1-fluoroethylene	1A'	Cs
590	CHFCHCl	(E)-1-chloro-2-fluoroethene	1A'	Cs
591	CHFCHClz	(Z)-1-Chloro-2-fluoroethene	1A'	Cs
592	CHBrCHBr	Ethene, 1,2-dibromo-, (E)-
593	CHBrCHBr	Ethene, 1,2-dibromo-, (Z)-
594	C2H4F2	1,2-difluoroethane	1Ag	C2H anti
595	C2H4F2	1,2-difluoroethane	1A	C2 gauche
596	CH3CHF2	Ethane, 1,1-difluoro-	1A'	Cs
597	CH2BrCH2Cl	1-bromo-2-chloroethane
598	CH2BrCH2Br	Ethane, 1,2-dibromo-	1Ag	C2h
599	CH2BrCH2Br	Ethane, 1,2-dibromo-	1A	C2
600	CH2CHCH2F	Allyl Fluoride
601	CH2CHCH2F	Allyl Fluoride
602	CH3CHCHF	trans-1-Fluoro-1-propene
603	CH2FCH2OH	2-fluoroethanol
604	CH2FCH2CH3	1-Fluoropropane	1A'	Cs
605	CH2FCH2CH3	1-Fluoropropane
606	CH3CHFCH3	2-Fluoropropane	1A'	Cs
607	CH3CHClCH3	Propane, 2-chloro-	1A'	Cs
608	B5H9	pentaborane9
609	C5H4	pentatetraene
610	C5H6	Propellane	1A1	D3h
611	C5H8	Bicyclo[1.1.1]pentane
612	C3H4N2	2H-Imidazole	1A1	C2v
613	C4H5N	Pyrrole	1A1	C2v
614	C3O2	Carbon suboxide	1ΣG	D∞h
615	B2O3	diboron trioxide
616	B2O3	diboron trioxide
617	CHOOCHO	diformyl ether
618	C3H3NO	Isoxazole	1A'	Cs
619	C3H3NS	Thiazole
620	C4H4O	Furan	1A1	C2
621	CH3COCCH	3-butyn-2-one	1A'	Cs
622	C4H4Se	selenophene
623	HCOOC2H5	Ethyl formate	1A'	Cs
624	C2H6O2S	Dimethyl sulfone	1A1	C2v
625	C4H8S	Thiophene, tetrahydro-	1A	C1
626	C4H10O	Ethoxy ethane	1A1	C2v
627	C4H10O	Methyl propyl ether	1A	C1
628	C(CH3)3SH	2-Propanethiol, 2-methyl-	1A'	Cs
629	C4H9SH	1-Butanethiol
630	CF3Cl	Methane, chlorotrifluoro-	1A1	C3v
631	CF2Cl2	difluorodichloromethane	1A1	C2v
632	CF3Br	Bromotrifluoromethane	1A1	C3v
633	GeF4	Germanium tetrafluoride	1A1	Td
634	CCl4	Carbon tetrachloride	1A1	Td
635	CBrCl2F	bromodichlorofluoromethane
636	CBr2ClF	dibromochlorofluoromethane
637	CBr2Cl2	dibromodichloromethane	1A1	C2v
638	CBr3Cl	tribromochloromethane	1A1	C3v
639	CBr4	Carbon tetrabromide	1A1	Td
640	GeBr4	Germanium tetrabromide
641	SF4	Sulfur tetrafluoride	1A1	C2v
642	SeF4	Selenium tetrafluoride
643	SCl4	Sulfur tetrachloride
644	CH2ClCCCl	1,3-dichloropropyne
645	CHCl2CCH	3,3-dichloropropyne
646	CHCl2CHO	dichloroacetaldehyde
647	CHF2CH2F	Ethane, 1,1,2-trifluoro	1A	C1
648	CHF2CH2F	Ethane, 1,1,2-trifluoro	1A'	Cs
649	CH2CClCHCH2	1,3-Butadiene, 2-chloro-
650	CH2FCH2CH2F	1,3-difluoropropane
651	CH3CCl2CH3	Propane, 2,2-dichloro-	1A1	C2v
652	C2H2N2O	Furazan
653	C6H6	Prismane
654	C6H6	1,2,4,5-Hexatetraene	1Ag	C2h
655	C6H6	Benzene	1A1g	D6h
656	C6H6	Benzvalene	1A1	C2v
657	C6H6	Dewar Benzene
658	N3P3	1,3,5,2,4,6-Triazatriphosphorine
659	C3H2O3	vinylene carbonate
660	C5H6O	2H-Pyran
661	C5H6O	Pentadienal
662	C4H6O2	γ–Butyrolactone	1A	C1
663	C3H6O3	1,3,5-Trioxane	1A1	C1
664	C4H8O2	Ethyl acetate	1A'	Cs
665	C5H10O	3-Pentanone	1A1	C2v
666	C4F2	difluorobutadiyne
667	C2ClF3	Ethene, chlorotrifluoro-
668	C2Br4	tetrabromoethene
669	SiF5-	silicon pentafluoride anion
670	PF5	Phosphorus pentafluoride	1A1'	D3h
671	CHCl2CHCl2	Ethane, 1,1,2,2-tetrachloro-
672	CH2BrCBr3	1,1,1,2-tetrabromo ethane
673	C7H7	cycloheptatrienyl radical	2A2	C2v
674	C7H7+	cycloheptatrienyl cation	1A1'	D7h
675	CH(CN)3	tricyanomethane
676	HN=C=C(CN)2	Dicyanoketenimine
677	C5H4O2	furfural	1A'	OCCO cis
678	C5H4O2	furfural	1A'	OCCO trans
679	C6H12O	Oxepane
680	F2CCCF2	tetrafluoroallene
681	SF6	Sulfur Hexafluoride	1A1G	Oh
682	C8H8	cubane	1A1G	Oh
683	S4N4	Tetrasulfur tetranitride
684	C6H5CHO	benzaldehyde	1A'	Cs
685	C6H4F2	1,4-difluorobenzene	1Ag	D2h
686	C6H4Cl2	1,4-dichlorobenzene
687	C6H5NO	nitrosobenzene	1A'	Cs
688	C3F6	hexafluoropropene
689	C8H18O	1-Octanol
690	C10H10	bullvalene
691	B12H12--	Dodecahydrododecaborate(2-)
692	C13H10	Fluorene
693	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	H+	Hydrogen atom cation	h+
6	D2	Deuterium diatomic	d2
7	H2-	hydrogen diatomic anion	h2-
8	H2+	Hydrogen cation	h2+
9	HD	Deuterium hydride	hd
10	H3+	hydrogen trimer cation	h3+
11	He-	Helium atom anion	he-
12	HeH	Helium hydride	heh
13	Li-	Lithium atom anion	li-
14	Na-	Sodium atom anion	na-
15	K-	Potassium atom anion	k-
16	K+	Potassium atom cation	k+
17	Cu-	Copper atom anion	cu-
18	Cu+	Copper atom cation	cu+
19	LiH-	lithium hydride anion	lih-
20	LiH+	lithium hydride cation	lih+
21	NaH	sodium hydride	nah
22	NaH-	sodium hydride anion	nah-
23	NaH+	sodium hydride cation	nah+
24	KH+	Potassium hydrogen cation	kh+
25	CuH	Copper monohydride	cuh
26	Be-	Beryllium atom anion	be-
27	Mg-	Magnesium atom anion	mg-
28	Ca	Calcium atom	ca
29	Ca-	Calcium atom anion	ca-
30	Ca+	Calcium atom cation	ca+
31	Zn-	Zinc atom anion	zn-
32	Zn+	Zinc atom cation	zn+
33	BeH	beryllium monohydride	beh
34	BeH-	berylium monohydride anion	beh-
35	BeH+	beryllium monohydride cation	beh+
36	MgH-	magnesium monohydride anion	mgh-
37	MgH+	magnesium monohydride cation	mgh+
38	CaH	Calcium monohydride	cah
39	CaH+	Calcium monohydride cation	cah+
40	TiH	Titanium monohydride	tih
41	ZnH	Zinc monohydride	znh
42	BeH2	beryllium dihydride	beh2
43	MgH2	magnesium dihydride	mgh2
44	CaH2	Calcium Hydride	cah2
45	ZnH2	Zinc hydride	znh2
46	B-	Boron atom anion	b-
47	Sc	Scandium atom	sc
48	Sc+	Scandium cation	sc+
49	BH	Boron monohydride	bh
50	BH-	boron monohydride anion	bh-
51	BH+	boron monohydride cation	bh+
52	AlH	aluminum monohydride	alh
53	AlH-	aluminum monohydride anion	alh-
54	AlH+	aluminum monohydride cation	alh+
55	ScH	Scandium monohydride	sch
56	ScH+	Scandium monohydride cation	sch+
57	BH2	boron dihydride	bh2
58	BH2-	boron dihydride anion	bh2-
59	BH2+	Boron dihydride cation	bh2+
60	AlH2	aluminum dihydride	alh2
61	AlH2-	aluminum dihydride anion	alh2-
62	AlH2+	aluminum dihydride cation	alh2+
63	BH3	boron trihydride	bh3
64	BH3-	boron trihydride anion	bh3-
65	AlH3	aluminum trihydride	alh3
66	AlH3+	aluminum trihydride cation	alh3+
67	ScH3	Scandium trihydride	sch3
68	GaH3	Gallium trihydride	gah3
69	BH4	borohydride	bh4
70	AlH4-	Aluminum tetrahydride anion	alh4-
71	C-	Carbon atom anion	c-
72	Ti	Titanium atom	ti
73	Ti-	Titanium atom anion	ti-
74	Ti+	Titanium atom cation	ti+
75	Sn	Tin atom	sn
76	Sn+	Tin cation	sn+
77	CH-	methylidyne anion	ch-
78	CH+	Methylidyne cation	ch+
79	SiH-	silicon monohydride anion	sih-
80	SiH+	silicon monohydride cation	sih+
81	GeH+	Germaniun monohyrdide cation	geh+
82	CH2	Methylene	ch2
83	CH2+	methylene cation	ch2+
84	SiH2	silicon dihydride	sih2
85	SiH2-	silicon dihydride anion	sih2-
86	SiH2+	silicon dihydride cation	sih2+
87	GeH2-	germylene anion	geh2-
88	CH3-	methyl anion	ch3-
89	CH3+	methyl cation	ch3+
90	SiH3-	Silyl anion	sih3-
91	CD4	methane-d4	cd4
92	CH2D2	methane-d2	ch2d2
93	CH3D	methane-d	ch3d
94	CH4-	Methane anion	ch4-
95	CH4+	Methane cation	ch4+
96	CHD3	methane-d3	chd3
97	SiH4+	Silane cation	sih4+
98	SnH4	Stannane	snh4
99	N-	Nitrogen atom anion	n-
100	P-	Phosphorus atom anion	p-
101	P+	Phosphorus atom cation	p+
102	V	Vanadium atom	v
103	Sb	Antimony atom	sb
104	NH	Imidogen	nh
105	NH-	Imidogen anion	nh-
106	NH+	imidogen cation	nh+
107	PH-	phosphorus monohydride anion	ph-
108	PH+	phosphorus monohydride cation	ph+
109	AsH+	Arsenic monohydride cation	ash+
110	SbH	Antimony monohydride	sbh
111	ND2	Amidogen-d2	nd2
112	NH2-	amino anion	nh2-
113	PH2	Phosphino radical	ph2
114	PH2-	Phosphino anion	ph2-
115	PH2+	Phosphino cation	ph2+
116	AsH2	Arsenic dihydride	ash2
117	AsH2+	Arsenic dihydride cation	ash2+
118	ND3	Ammonia-d3	nd3
119	NH3-	Ammonia anion	nh3-
120	NH3+	ammonia cation	nh3+
121	SbH3	Stibine	sbh3
122	NH4+	ammonium cation	nh4+
123	PH4+	phosphonium cation	ph4+
124	O-	Oxygen atom anion	o-
125	S-	Sulfur atom anion	s-
126	S+	Sulfur atom cation	s+
127	Cr	Chromium atom	cr
128	Te	Tellurium atom	te
129	Te+	Tellurium atom cation	te+
130	DO	Hydroxyl-d	od
131	OH-	hydroxide anion	oh-
132	DS	Mercapto-d	ds
133	HS	Mercapto radical	hs
134	CrH	Chromium hydride	crh
135	TeH	Telluryl radical	teh
136	D2O	Deuterium oxide	d2o
137	D2S	Hydrogen sulfide-d2	d2s
138	H2S	Hydrogen sulfide	h2s
139	H2S-	Hydrogen sulfide anion	h2s-
140	H2Te	Hydrogen Telluride	h2te
141	H3O+	hydronium cation	h3o+
142	F-	Fluorine atom anion	f-
143	Cl-	Chlorine atom anion	cl-
144	Mn	Manganese atom	mn
145	I	Iodine atom	iodine
146	I-	Iodine atom anion	iodine-
147	I+	Iodine atom cation	iodine+
148	DF	Hydrofluoric acid-d	df
149	DCl	Hydrochloric acid-d	dcl
150	HI	Hydrogen iodide	hi
151	HI+	Hydrogen iodide cation	hi+
152	H2F+	dihydrogen fluoride cation	h2f+
153	H2I+	Iodonium	h2i+
154	Ne-	Neon atom anion	ne-
155	Ar-	Argon atom anion	ar-
156	Ar+	Argon atom cation	ar+
157	Fe	Iron atom	fe
158	Xe	Xenon atom	xe
159	NeH	neon hydrogen	neh
160	NeH+	neon hydrogen cation	neh+
161	XeH+	Xenon, protonated	xeh+
162	H2Ar	H2 Ar dimer	h2ar
163	Co	Cobalt atom	cobalt
164	Ni	Nickel atom	ni
165	Li2	Lithium diatomic	li2
166	Li2-	lithium diatomic anion	li2-
167	Li2+	lithium diatomic cation	li2+
168	NaLi-	lithium sodium anion	lina-
169	NaLi+	lithium sodium cation	lina+
170	LiK	Lithium Potassium	lik
171	Na2+	sodium diatomic cation	na2+
172	NaK	Sodium Potassium	nak
173	NaK+	Sodium Potassium diatomic cation	nak+
174	K2	Potassium diatomic	k2
175	Cu2	Copper diatomic	cu2
176	LiBe	Lithium Beryllium	libe
177	LiMg	Lithium magnesium	limg
178	NaBe	Sodium Beryllium	nabe
179	NaMg	Sodium Magnesium	namg
180	Be2	Beryllium diatomic	be2
181	Be2-	Beryllium diatomic anion	be2-
182	Be2+	Beryllium diatomic cation	be2+
183	BeMg	Beryllium Magnesium	bemg
184	Mg2	Magnesium diatomic	mg2
185	Mg2-	magnesium diatomic anion	mg2-
186	Mg2+	magnesium diatomic cation	mg2+
187	Ca2	Calcium diatomic	ca2
188	LiB	Lithium boride	lib
189	NaAl	Sodium aluminum	naal
190	BeB	Beryllium monoboride	beb
191	B2	Boron diatomic	b2
192	B2-	Boron diatomic anion	b2-
193	B2+	Boron diatomic cation	b2+
194	BAl	Boron Aluminum	bal
195	Al2	Aluminum diatomic	al2
196	Al2-	aluminum diatomic anion	al2-
197	Al2+	aluminum diatomic cation	al2+
198	BGa	Boron Gallium	bga
199	AlGa	Aluminum Gallium	alga
200	Ga2	Gallium diatomic	ga2
201	LiBH4	Lithium borohydride	libh4
202	HBHHBH	Diborane(4) C2V	hbhhbh
203	Al2H6	dialane	al2h6
204	Ga2H6	digallane	ga2h6
205	LiC	Lithium Carbide	lic
206	BeC	Beryllium Carbide	bec
207	BC	boron monocarbide	bc
208	BC-	boron monocarbide anion	bc-
209	BC+	boron monocarbide cation	bc+
210	AlC	Aluminum carbide	alc
211	C2	Carbon diatomic	c2
212	C2-	carbon diatomic anion	c2-
213	C2+	carbon diatomic cation	c2+
214	SiC	silicon monocarbide	sic
215	SiC-	silicon monocarbide anion	sic-
216	SiC+	silicon monocarbide cation	sic+
217	Si2-	silcon diatomic anion	si2-
218	Si2+	silcon diatomic cation	si2+
219	Ge2	Germanium diatomic	ge2
220	C2H	Ethynyl radical	c2h
221	C2H+	Ethynyl cation	c2h+
222	ZnCH2	Zinc methylene	znch2
223	CCH2	vinylidene	vinylidene
224	CuCH3	monomethyl copper	cuch3
225	ZnCH3	Zinc monomethyl	znch3
226	CH2BH	methyleneborane	ch2bh
227	C2H3-	vinyl anion	c2h3-
228	C2H4-	Ethylene anion	c2h4-
229	CH3CH	methylmethylene	ch3ch
230	CH2SiH2	silaethylene	ch2sih2
231	CH3BH2	methylborane	ch3bh2
232	C2H5-	Ethyl anion	c2h5-
233	C2H5+	Ethyl cation	c2h5+
234	C2H6+	ethane cation	c2h6+
235	CH3SiH3	methyl silane	ch3sih3
236	GeH3CH3	methyl germane	geh3ch3
237	C2H7+	Ethane, protonated	c2h7+
238	LiN+	Lithium Nitride cation	lin+
239	BeN	Beryllium mononitride	ben
240	BeN-	Beryllium mononitride anion	ben-
241	BeN+	Beryllium mononitride cation	ben+
242	BN-	boron nitride anion	bn-
243	AlN-	aluminum mononitride anion	aln-
244	AlN+	aluminum mononitride cation	aln+
245	BP	Boron monophosphide	bp
246	AlP	Aluminum monophosphide	alp
247	GaN	Gallium mononitride	gan
248	GaP	Gallium monophosphide	gap
249	BN	boron nitride	bn
250	BN+	boron nitride cation	bn+
251	AlN	Aluminum nitride	aln
252	CN-	cyanide anion	cn-
253	CN+	Cyano cation	cn+
254	CP	Carbon monophosphide	cp
255	CP-	carbon monophosphide anion	cp-
256	CP+	carbon monophosphide cation	cp+
257	SiN	Silicon nitride	sin
258	SiN-	silicon mononitride anion	sin-
259	SiN+	silicon mononitride cation	sin+
260	SiP-	Silicon monophosphide anion	sip-
261	SiP+	Silicon monophosphide cation	sip+
262	TiN	Titanium mononitride	tin
263	N2-	nitrogen diatomic anion	n2-
264	N2+	diatomic nitrogen cation	n2+
265	PN-	phosphorus nitride anion	pn-
266	PN+	phosphorus nitride cation	pn+
267	P2	Phosphorus diatomic	p2
268	P2-	phosphorus diatomic anion	p2-
269	P2+	phosphorus diatomic cation	p2+
270	AsN	Arsenic mononitride	asn
271	AsP	Arsenic monophosphide	asp
272	SbN	Antimony nitride	sbn
273	As2	Arsenic diatomic	as2
274	HNB	hydrogen nitrogen boron	hnb
275	HNC	hydrogen isocyanide	hnc
276	HCN-	Hydrogen cyanide anion	hcn-
277	HCP	Phosphaethyne	hcp
278	NNH	Dinitrogen monohydride	nnh
279	HPO	Hydrogen phosphorus oxide	hpo
280	HPO+	Hydrogen phosphorus oxide cation	hpo+
281	CNH2	Aminomethylidyne radical	cnh2
282	CNH2+	N-protonated hydrogen isocyanide	cnh2+
283	H2CN	Dihydrogen cyanide radical	h2cn
284	H2CN+	hydrocyanonium cation	h2cn+
285	HCNH	methyleneazane	hcnh
286	HCNH+	N-protonated HCN	hcnh+
287	N2H2	(E)-diazene	n2h2
288	N2H2	(Z)-Diazene	n2h2z
289	CH2PH	Phosphaethene	ch3p
290	CH2NH2+	methyleneamine cation	ch2nh2+
291	N2H4+	hydrazine cation	n2h4+
292	P2H4	Diphosphine	p2h4
293	CH3NH2+	methyl amine cation	ch3nh2+
294	CH3PH2	Methyl phosphine	ch3ph2
295	N2H5+	protonated hydrazine	n2h5+
296	CH3NH3+	protonated methylamine	ch3nh3+
297	CH3PH3+	methyl phosphine, protonated	ch3ph3+
298	NH3NH3	Ammonia Dimer	nh3nh3
299	LiO	lithium oxide	lio
300	LiO-	lithium oxide anion	lio-
301	LiO+	lithium oxide cation	lio+
302	LiS	Lithium monosulfide	lis
303	LiS+	Lithium sulfide cation	lis+
304	NaO	sodium monoxide	nao
305	NaO-	sodium oxide anion	nao-
306	NaO+	sodium oxide cation	nao+
307	KO	Potassium monoxide	ko
308	KO+	Potassium monoxide cation	ko+
309	NaS	Sodium sulfide	nas
310	CuO	Copper Monoxide	cuo
311	BeO	beryllium oxide	beo
312	BeO-	Beryllium monoxide anion	beo-
313	BeO+	Beryllium monoxide cation	beo+
314	BeS	beryllium sulfide	bes
315	MgO	magnesium oxide	mgo
316	MgO-	magnesium oxide anion	mgo-
317	MgO+	magnesium oxide cation	mgo+
318	MgS	magnesium sulfide	mgs
319	MgS-	magnesium sulfide anion	mgs-
320	MgS+	magnesium sulfide cation	mgs+
321	ZnO	zinc monoxide	zno
322	ZnS	Zinc sulfide	zns
323	BeS-	Beryllium monosulfide anion	bes-
324	BeS+	Beryllium monosulfide cation	bes+
325	BO-	boron monoxide anion	bo-
326	AlO	Aluminum monoxide	alo
327	AlO-	Aluminum monoxide anion	alo-
328	AlO+	aluminum monoxide cation	alo+
329	BS	boron sulfide	bs
330	BS-	boron monosulfide anion	bs-
331	BS+	boron monosulfide cation	bs+
332	AlS	Aluminum sulfide	als
333	AlS-	aluminum monosulfide anion	als-
334	AlS+	aluminum monosulfide cation	als+
335	ScO	Scandium monoxide	sco
336	BO+	boron monoxide cation	bo+
337	CS	carbon monosulfide	cs
338	CS-	carbon monosulfide anion	cs-
339	CS+	carbon monosulfide cation	cs+
340	SiO-	silicon monoxide anion	sio-
341	SiO+	silicon monoxide cation	sio+
342	SiS-	silicon monosulfide anion	sis-
343	SiS+	silicon monosulfide cation	sis+
344	TiO	Titanium monoxide	tio
345	CSe-	Carbon monoselenide anion	cse-
346	CSe+	Carbon monoselenide cation	cse+
347	GeO+	Germanium monoxide cation	geo+
348	GeS	Germanium monosulfide	ges
349	NS	Mononitrogen monosulfide	ns
350	NS-	nitrogen sulfide anion	ns-
351	NS+	nitrogen sulfide cation	ns+
352	PO-	phosphorus monoxide anion	po-
353	PO+	phosphorus monoxide cation	po+
354	PS-	phosphorus monosulfide anion	ps-
355	PS+	phosphorus monosulfide cation	ps+
356	VO	Vanadium monoxide	vo
357	AsO	Arsenic monoxide	aso
358	O2-	oxygen diatomic anion	o2-
359	O2+	diatomic oxygen cation	o2+
360	SO-	sulfur monoxide anion	so-
361	S2-	sulfur diatomic anion	s2-
362	S2+	sulfur diatomic cation	s2+
363	SeO-	selenium monoxide anion	seo-
364	SeO+	selenium monoxide cation	seo+
365	SeS	Selenium monosulfide	ses
366	SeS-	selenium monosulfide anion	ses-
367	SeS+	selenium monosulfide cation	ses+
368	TeO	Tellurium monoxide	teo
369	Se2-	selenium diatomic anion	se2-
370	Se2+	selenium diatomic cation	se2+
371	Te2	Tellurium diatomic	te2
372	NaOH	sodium hydroxide	naoh
373	MgOH	magnesium hydroxide	mgoh
374	CaOH	Calcium monohydroxide	caoh
375	COH+	Carbon Monoxide, protonated	coh+
376	HCS	Thioformyl radical	hcs
377	HCS-	Thioformyl anion	hcs-
378	HCS+	Thioformyl cation	hcs+
379	HNO-	Nitrosyl hydride anion	hno-
380	NOH	Hydroxyimidogen	noh
381	NOH+	O-protonated nitric oxide	noh+
382	HNS	Sulfur imide	hns
383	HNS-	Sulfur imide anion	hns-
384	HO2	Hydroperoxy radical	ho2
385	HO2-	Hydroperoxy anion	ho2-
386	HO2+	Hydroperoxy cation	ho2+
387	HS2	Thiosulfeno radical	hs2
388	HOCH	hydroxycarbene	hoch
389	H2CS+	thioformaldehyde cation	h2cs+
390	H2NO	nitroxide	h2no
391	H2O2+	Hydrogen peroxide cation	h2o2+
392	H2S2	Disulfane	h2s2
393	H2S2+	hydrogen disulfide cation	h2s2+
394	CH2OH	Hydroxymethyl radical	ch2oh
395	CH3O	Methoxy radical	ch3o
396	CH3O+	Methoxy cation	ch3o+
397	CH3S	thiomethoxy	ch3s
398	H2CSH+	Thioformaldehyde, protonated	h2csh+
399	NH3O	Ammonia Oxide	nh3o
400	H2POH	Phosphinous acid	h2poh
401	H3PO	Phosphine oxide	h3po
402	H3O2+	hydrogen peroxide, protonated	h3o2+
403	CH3OH-	Methyl alcohol anion	ch3oh-
404	CH3SH+	Methanethiol cation	ch3sh+
405	CH3SeH	Methane selenol	ch3seh
406	H2OH2O	water dimer	h2oh2o
407	CH3OH2+	Methanol, protonated	ch3oh2+
408	CH3SH2+	protonated methylsulfide	ch3sh2+
409	H2ONH3	Water Ammonia Dimer	h2onh3
410	LiCl-	lithium chloride anion	licl-
411	LiCl+	lithium chloride cation	licl+
412	NaF	sodium fluoride	naf
413	NaF-	sodium fluoride anion	naf-
414	KF	Potassium Fluoride	kf
415	NaCl	Sodium Chloride	nacl
416	NaCl-	sodium chloride anion	nacl-
417	NaCl+	sodium chloride cation	nacl+
418	KCl	Potassium Chloride	kcl
419	CuF	Copper monofluoride	cuf
420	LiBr-	lithium bromide anion	libr-
421	LiBr+	lithium bromide cation	libr+
422	CuCl	Copper monochloride	cucl
423	NaBr	Sodium Bromide	nabr
424	NaBr-	sodium bromide anion	nabr-
425	NaBr+	sodium bromide cation	nabr+
426	KBr	Potassium Bromide	kbr
427	LiI	Lithium Iodide	lii
428	NaI	Sodium Iodide	nai
429	KI	Potassium Iodide	ki
430	LiF-	lithium fluoride anion	lif-
431	BeF	Beryllium monofluoride	bef
432	BeF-	Beryllium monofluoride anion	bef-
433	BeF+	Beryllium monofluoride cation	bef+
434	BeCl	beryllium monochloride	becl
435	MgF	Magnesium monofluoride	mgf
436	MgF-	magnesium fluoride anion	mgf-
437	MgF+	magnesium fluoride cation	mgf+
438	CaF	Calcium monofluoride	caf
439	MgCl	magnesium monochloride	mgcl
440	MgCl-	magnesium monochloride anion	mgcl-
441	MgCl+	magnesium monochloride cation	mgcl+
442	CaCl	calcium monochloride	cacl
443	TiCl	Titanium Monochloride	ticl
444	ZnF	Zinc monofluoride	znf
445	ZnF-	Zinc monofluoride anion	znf-
446	ZnF+	Zinc monofluoride cation	znf+
447	ZnCl	Zinc monochloride	zncl
448	BeCl-	beryllium monochloride anion	becl-
449	BeCl+	beryllium monochloride cation	becl+
450	BF-	Boron monofluoride anion	bf-
451	BF+	Boron monofluoride cation	bf+
452	AlF-	Aluminum monofluoride anion	alf-
453	AlF+	Aluminum monofluoride cation	alf+
454	BCl	boron monochloride	bcl
455	BCl-	boron monochloride anion	bcl-
456	BCl+	boron monochloride cation	bcl+
457	AlCl	Aluminum monochloride	alcl
458	AlCl-	aluminum monochloride anion	alcl-
459	AlCl+	aluminum monochloride cation	alcl+
460	ScF	Scandium monofluoride	scf
461	BBr	Boron monobromide	bbr
462	GaF+	Gallium monofluoride cation	gaf+
463	GaCl+	Gallium monochloride cation	gacl+
464	AlI	Aluminum monoiodide	ali
465	CF-	carbon monofluoride anion	cf-
466	CF+	carbon monofluoride cation	cf+
467	CCl	carbon monochloride	ccl
468	CCl-	carbon monochloride anion	ccl-
469	CCl+	carbon monochloride cation	ccl+
470	SiF	silicon monofluoride	sif
471	SiF-	silicon monofluoride anion	sif-
472	SiF+	silicon monofluoride cation	sif+
473	SiCl-	silicon monochloride anion	sicl-
474	SiCl+	silicon monochloride cation	sicl+
475	GeF+	Germanium monofluoride cation	gef+
476	NF	nitrogen fluoride	nf
477	NF-	nitrogen monofluorine anion	nf-
478	NF+	nitrogen monofluoirde cation	nf+
479	NCl-	nitrogen monochloride anion	ncl-
480	NCl+	nitrogen monochloride cation	ncl+
481	PF	phosphorus monofluoride	pf
482	PF-	phosphorus monofluoride anion	pf-
483	PF+	phosphorus monofluoride cation	pf+
484	PCl	phosphorus chloride	pcl
485	PCl-	phosphorus monochloride anion	pcl-
486	PCl+	phosphorus monochloride cation	pcl+
487	AsF	Arsenic monofluoride	asf
488	NBr	nitrogen monobromide	nbr
489	AsCl	Arsenic monochloride	ascl
490	SbF	Antimony monofluoride	sbf
491	SbCl	Antimony monochloride	sbcl
492	FO	Oxygen monofluoride	fo
493	FO-	flourine oxide anion	fo-
494	FO+	fluorine monoxide cation	fo+
495	ClO-	chlorine monoxide anion	clo-
496	SF-	sulfur monofluoride anion	sf-
497	SCl	sulfur monochloride	scl
498	SCl-	sulfur monochloride anion	scl-
499	BrO-	Bromine monoxide anion	bro-
500	SeF	Selenium monofluoride	sef
501	SeCl	Selenium monochloride	secl
502	IO	Iodine monoxide	io
503	F2-	flourine diatomic anion	f2-
504	ClF-	clorine monofluoride anion	clf-
505	Cl2-	chlorine diatomic anion	cl2-
506	BrF-	bromine fluoride anion	brf-
507	BrF+	bromine fluoride cation	brf+
508	BrCl-	bromine chloride anion	brcl-
509	BrCl+	bromine chloride cation	brcl+
510	IF	Iodine monofluoride	if
511	ICl	Iodine monochloride	icl
512	IBr	Iodine monobromide	ibr
513	I2	Iodine diatomic	i2
514	I2+	Iodine diatomic cation	i2+
515	HCCl	Chloromethylene	hccl
516	CHBr	bromomethylene	chbr
517	DOCl	Hypochlorous acid-d	docl
518	HOBr	Hypobromous acid	hobr
519	HOBr+	Hypobromous acid cation	hobr+
520	HOI	Hypoiodous acid	hoi
521	FHF	Hydrogen difluoride	fhf
522	FHF-	Hydrogen difluoride anion	fhf-
523	NH2F	monofluoroamine	nh2f
524	H2F2	Hydrogen fluoride dimer	h2f2
525	CD3F	methylfluoride-d3	cd3f
526	CD3Cl	methyl chloride d3	cd3cl
527	SiH3Br	bromosilane	sih3br
528	CH3I	methyl iodide	ch3i
529	SiH3I	Silyl Iodide	sih3i
530	Ne2	Neon diatomic	ne2
531	Ne2+	Neon diatomic cation	ne2+
532	Ar2+	Argon diatomic cation	ar2+
533	Li3	Lithium trimer	li3
534	Li3+	Lithium trimer cation	li3+
535	C3+	carbon trimer cation	c3+
536	C3H3	cyclopropenyl radical	cpr
537	C3H3	Propargyl radical	propargyl
538	C3H3-	Propargyl anion	c3h3-
539	C3H3+	cyclopropenyl cation	cpr+
540	C3H3+	Propargyl cation	c3h3+
541	C3H5+	Allyl cation	allyl+
542	CH3CHCH	1-propenyl radical	ch3chch
543	Zn(CH3)2	dimethyl zinc	dmz
544	C3H7+	cyclopropane, protonated	c3h7+
545	SiH2(CH3)2	dimethylsilane	dms
546	NaCN	Sodium Cyanide	nacn
547	CuCN	Copper cyanide	cucn
548	CN2	3H-Diazirin-3-ylidene	cn2
549	NCN	Cyanoimidogen	ncn
550	N3-	azide anion	n3-
551	N3+	azide cation	n3+
552	HCCN	cyanomethylene	hccn
553	HCNN	diazomethyl radical	hcnn
554	CH2N2	diazirine	ch2n2
555	CH2NN	diazomethane	ch2nn
556	NH2CN	cyanamide	cyanamide
557	CH3CN+	Acetonitrile cation	ch3cn+
558	CH3NC	methyl isocyanide	ch3nc
559	HNCNH2+	diiminomethane, protonated	hncnh2+
560	NCNH3+	Cyanamide, protonated	ncnh3+
561	CH2CHNH	vinylazine	ch2chnh
562	CH3CHN	methylmethaniminyl radical	ch3chn
563	NHCHNH2	aminomethanimine	cn2h4
564	C2H5N	Aziridine	c2h5n
565	CH2CHNH2	aminoethene	aminoethene
566	CH2NCH3	N-methylmethanimine	nmm
567	CH3CHNH	ethanimine	ethanimine
568	NH2BHNH2	diaminoborane	nh2bhnh2
569	C2H5NH+	Protonated Aziridine	c2h5nh+
570	NH2CH2NH2	diaminomethane	nh2ch2nh2
571	CH3NHCH3	Dimethylamine	ch3nhch3
572	CH3PHCH3	dimethylphosphine	ch3phch3
573	NH2CH2NH3+	diaminoethane, protonated	pdam
574	(CH3)2NH2+	dimethylammonium cation	dmam
575	CH3CH2NH3+	ethylamine, protonated	pea
576	Li2O+	dilithium oxide cation	li2o+
577	Li2S	dilithium sulfide	li2s
578	CCO	Dicarbon monoxide	cco
579	CNO-	fulminate	cno-
580	NCO-	cyanate	nco-
581	SCN	thiocyanato radical	scn
582	SCN-	thiocyanide anion	scn-
583	BO2	Boron dioxide	bo2
584	BO2-	Boron dioxide anion	bo2-
585	BO2+	Boron dioxide cation	bo2+
586	N2O-	Nitrous oxide anion	n2o-
587	N2O+	Nitrous oxide cation	n2o+
588	NNS	Nitrogen sulfide	nns
589	PPO	Phosphorus oxide phosphide	ppo
590	CO2-	Carbon dioxide anion	co2-
591	CO2+	Carbon dioxide cation	co2+
592	OCS+	Carbonyl sulfide cation	cos+
593	SiO2	silicon dioxide	sio2
594	CS2-	Carbon disulfide anion	cs2-
595	CS2+	Carbon disulfide cation	cs2+
596	TiO2	Titanium dioxide	tio2
597	SiS2	Silicon disulfide	sis2
598	GeS2	Germanium disulfide	ges2
599	CSe2	Carbon diselenide	cse2
600	SCTe	Carbon sulfide Telluride	scte
601	NO2-	Nitrogen dioxide anion	no2-
602	NO2+	Nitrogen dioxide cation	no2+
603	PO2	Phosphorus dioxide	po2
604	PO2-	Phosphorus dioxide anion	po2-
605	PO2+	Phosphorus dioxide cation	po2+
606	AsO2	Aresenic dioxide	aso2
607	O3	Ozone	o3
608	O3-	Ozone anion	o3-
609	O3+	Ozone cation	o3+
610	SO2-	Sulfur dioxide anion	so2-
611	SO2+	Sulfur dioxide cation	so2+
612	S3-	Sulfur trimer anion	s3-
613	S3+	Sulfur trimer cation	s3+
614	SeO2+	Selenium dioxide cation	seo2+
615	TeO2	Tellurium Dioxide	teo2
616	CS2H+	Carbon disulfide, protonated	cs2h+
617	HNCO	Isocyanic acid	hnco
618	HOCN	cyanic acid	hocn
619	HCO2-	formate anion	hco2-
620	HNNO	nitrosoazane	hnno
621	HNNO+	Nitrous oxide, N-protonated	hnno+
622	NNOH+	Nitrous Oxide, O-protonated	nnoh+
623	HCOO	formate neutral radical	hcoo
624	HOCO+	Hydrocarboxyl cation	hoco+
625	HNO2	Nitrous acid	hno2
626	HNO2+	nitrous acid cation	hno2+
627	SO2H+	protonated sulfur dioxide	so2h+
628	CH2CO+	Ketene cation	ch2co+
629	HCCOH	ethynol	hccoh
630	Mg(OH)2	Magnesium dihydroxide	h2mgo2
631	NH2NO	Nitrosamide	nh2no
632	CH2O2	Dioxirane	diox
633	H2O3	Hydrogen trioxide	h2o3
634	HSSSH	trisulfane	hsssh
635	NaOCH3	Sodium methoxide	naoch3
636	CH2BOH	hydroxy(methylene)borane	ch2boh
637	CH3BO	Borane, methyloxo-	ch3bo
638	CH2CHO	Vinyloxy radical	ch2cho
639	CH3CO	Acetyl radical	ch3co
640	CH3CO-	Acetyl anion	ch3co-
641	CH3CO+	acetyl cation	ch3co+
642	CH2NOH	formaldoxime	ch2noh
643	CH3NO	nitrosomethane	ch3no
644	CHONH2	formamide	formamide
645	CNOH3	1,2-oxaziridine	cnoh3
646	CH2OOH	CH2OOH radical	ch2ooh
647	CH3OO	methylperoxy radical	ch3oo
648	CH3OO-	methylperoxy anion	ch3oo-
649	CH3OO+	methylperoxy cation	ch3oo+
650	CH2CHOH	ethenol	ch2choh
651	H2CONH2+	protonated formamide	h2conh2+
652	NH3CHO+	Formamide, N-Protonated	nh3cho+
653	CH2(OH)2	methanediol	ch2o2h2
654	CH3OOH	Methyl peroxide	ch3ooh
655	H2OH2CO	water formaldehyde dimer	h2oh2co
656	CH2CH2OH	2-hydroxy ethyl radical	ch2ch2oh
657	CH3CH2O	Ethoxy radical	ethoxy
658	CH3CHOH	1-hydroxy-ethyl radical	ch3choh
659	CH3CHOH+	acetaldehyde, protonated	ch3choh+
660	CH3OCH2	methoxymethyl radical	ch3och2
661	CH3SeCH3	dimethylselenide	dmse
662	CH3OHH2O	methanol water dimer	ch3ohh2o
663	H2OCH3OH	water methanol dimer	h2och3oh
664	CuF2	Copper difluoride	cuf2
665	ZnF2	Zinc difluoride	znf2
666	FCN	Cyanogen fluoride	fcn
667	ClCN	chlorocyanogen	clcn
668	ICN	Cyanogen iodide	icn
669	BeF2	Beryllium fluoride	bef2
670	MgF2	Magnesium fluoride	mgf2
671	BeCl2	Beryllium chloride	becl2
672	MgCl2	Magnesium dichloride	mgcl2
673	CaCl2	Calcium Chloride	cacl2
674	ZnCl2	Zinc dichloride	zncl2
675	CaF2	Calcium difluoride	caf2
676	FCO	Carbonyl fluoride	fco
677	FCO+	Carbonyl fluoride cation	fco+
678	ClCO	carbonyl monochloride	clco
679	FNS	Thionitrosyl fluoride	fns
680	BrNO	Nitrosyl bromide	brno
681	INO	Nitrosyl iodide	ino
682	CF2-	Difluoromethylene anion	cf2-
683	CF2+	Difluoromethylene cation	cf2+
684	SiF2+	Silicon difluoride cation	sif2+
685	CCl2	dichloromethylene	ccl2
686	CCl2-	dichloromethylene anion	ccl2-
687	CCl2+	dichloromethylene cation	ccl2+
688	SiCl2	Dichlorosilylene	sicl2
689	GeF2	Germanium difluoride	gef2
690	FOO	Dioxygen monofluoride radical	foo
691	ClOO	chloroperoxy radical	cloo
692	ClOO+	chloroperoxy cation	cloo+
693	OClO+	Chlorine dioxide cation	oclo+
694	ClSO	Sulfur chloride oxide	clso
695	ClS2	Sulfur chloride	cls2
696	OBrO	Bromine dioxide radical	obro
697	NF2	Difluoroamino radical	nf2
698	NF2+	Difluoroamino cation	nf2+
699	F2O	Difluorine monoxide	f2o
700	SF2-	sulfur difluoride anion	sf2-
701	SF2+	sulfur difluoride cation	sf2+
702	Cl2O	Dichlorine monoxide	cl2o
703	SCl2	Sulfur dichloride	scl2
704	BrOCl	Bromine hypochlorite	brocl
705	BrOBr	Bromine oxide	brobr
706	F3-	trifluoride anion	f3-
707	Cl3-	trichloride anion	cl3-
708	I3-	triiodide	i3-
709	HCCF+	fluoroacetylene cation	hccf+
710	HCCCl	Chloroacetylene	hcccl
711	HFCO	formyl fluoride	hfco
712	HFCO+	formyl fluoride cation	hfco+
713	COHCl	Formyl chloride	cohcl
714	COHBr	Formyl bromide	cohbr
715	BHF2	Difluoroborane	bhf2
716	BHCl2	Borane, dichloro-	bhcl2
717	CHCl2	dichloromethyl radical	chcl2
718	HOClO	Chlorous acid	hoclo
719	CH2FCl	fluorochloromethane	ch2fcl
720	CH2BrF	Methane, bromofluoro-	ch2fbr
721	CH2FI	fluoroiodomethane	ch2fi
722	CH2ClI	chloroiodomethane	ch2cli
723	CH2BrI	bromoiodomethane	ch2bri
724	CH2I2	Diiodomethane	ch2i2
725	SiH2Cl2	dichlorosilane	sih2cl2
726	CH2CHF+	fluoroethene cation	ch2chf+
727	C2H3Cl	Ethene, chloro-	ch2chcl
728	C2H3Br	vinyl bromide	c2h3br
729	C2H3I	Vinyl iodide	c2h3i
730	CH3OCl	methyl hypochlorite	ch3ocl
731	C2H5F	fluoroethane	c2h5f
732	CH3CH2Cl	Ethyl chloride	c2h5cl
733	CH3SiFH2	fluoromethylsilane	ch3sifh2
734	C2H5I	Ethyl iodide	c2h5i
735	KrF2	Krypton difluoride	krf2
736	XeF2	Xenon difluoride	xef2
737	B4H10	Tetraborane(10)	b4h10
738	C4+	Carbon tetramer cation	c4+
739	C4H2	Diacetylene	c4h2
740	C2H3CCH	1-Buten-3-yne	c2h3cch
741	C4H4	cyclobutadiene	cbd
742	H2CCCCH2	Butatriene	h2cccch2
743	C4H6	Cyclobutene	c822355
744	C4H6	Methylenecyclopropane	c6142730
745	CH2CCHCH3	1,2-Butadiene	butad12
746	CH2CHCHCH2	1,3-Butadiene	c106990
747	CH3CCCH3	2-Butyne	c503173
748	CHCCH2CH3	1-Butyne	c107006
749	CH3CHCHCH2	methylallyl radical	c4h7
750	C4H8	methylcyclopropane	mcp
751	CH2C(CH3)CH3	1-Propene, 2-methyl-	isobute
752	CH3CHCHCH3	2-Butene, (E)-	bute2e
753	CH3CHCHCH3	2-Butene, (Z)-	bute2z
754	B(CH3)3	trimethylborane	bme3
755	Al(CH3)3	trimethyl aluminum	tma
756	C(CH3)3	Tert-butyl radical	tbutyl
757	CH2CH(CH3)2	Isobutyl radical	isobutyl
758	CH3CHCH2CH3	2-Butyl radical	butyl2
759	CH3CH(CH3)CH3	Isobutane	isobutane
760	SiH(CH3)3	trimethylsilane	trimsi
761	Li3N	trilithium nitride	li3n
762	C2N2	Cyanogen	c2n2
763	C2N2+	Cyanogen cation	c2n2+
764	P4	Phosphorus tetramer	p4
765	HCCCN	Cyanoacetylene	hcccn
766	C3H3N	acrylonitrile	ch2chcn
767	C3H3N+	acrylonitrile cation	ch2chcn+
768	CH3N3	methyl azide	ch3n3
769	NH2CCNH2	Diaminoacetylene	daa
770	NH2CH2CN	Aminoacetonitrile	aan
771	CH3NHN2+	methyl azide, protonated	ch3nhn2+
772	CH5N3	Guanidine	guanidine
773	C4H6	Bicyclo[1.1.0]butane	c157335
774	CH3NNCH3	(Z)-1,2-Dimethyldiazene	dmdiazz
775	CH6N3+	guanidinium	ch6n3+
776	C3H7N	Cyclopropylamine	cpram
777	C3H7N	Azetidine	azet
778	C4H8	cyclobutane	cbutane
779	C2H8N2	Ethylenediamine	ethdiam
780	CH3NHNHCH3	dimethyl hydrazine	dmh
781	CH3CH(NH2)CH3	2-Propanamine	pram2
782	N(CH3)3	Trimethylamine	trimeam
783	P(CH3)3	trimethylphosphine	tmp
784	As(CH3)3	trimethyl arsine	tmas
785	(CH3)3NH+	protonated trimethyl amine	ptma
786	C3H7NH3+	n-propylamine, protonated	c3h7nh2
787	Li2O2	dilithium dioxide	li2o2
788	C3O	Tricarbon monoxide	c3o
789	B2O2	Diboron dioxide	b2o2
790	CO3	Carbon trioxide	co3
791	CO3--	carbonate	co3--
792	NO3	Nitrogen trioxide	no3
793	NO3-	nitrate anion	no3-
794	NO3+	nitrogen trioxide cation	no3+
795	SO3-	Sulfur trioxide anion	so3-
796	SO3+	Sulfur trioxide cation	so3+
797	SeO3	selenium trioxide	seo3
798	TeO3	Tellurium trioxide	teo3
799	HCO3-	bicarbonate anion	hco3-
800	HSO3	Hydroxysulfonyl radical	hso3
801	NH2NO2	nitramide	nh2no2
802	C2H2CO	cyclopropenone	c2h2co
803	HCCCHO	2-propynal	hcccho
804	C2H2O2+	Ethanedial cation	c2h2o2+
805	H2CO3	Carbonic acid	h2co3
806	H2CS3	thiocarbonic acid	h2cs3
807	H2NO3+	Nitric Acid, Protonated	h2no3+
808	H2SO3	Sulfurous acid	h2so3
809	C2H3NO	Nitrosoethylene	c2h3no
810	CH3COO-	acetate anion	ch3coo-
811	CH3ONO	Methyl nitrite	ch3ono
812	NH2COOH	Carbamic acid	nh2cooh
813	H3BO3	Boric acid	h3bo3
814	H3CO3+	carbonic acid, protonated	h3co3+
815	C3H4O	2-Propyn-1-ol	c107197
816	C3H4O	allenol	c9000071
817	C3H4O	Cyclopropanone	cpone
818	C3H4O	Methylketene	c6004440
819	NH2CONH2	Urea	urea
820	NH2CONH2+	Urea cation	urea+
821	NH2CSNH2	Thiourea	thiourea
822	C2H4O2	1,3-dioxetane	c2h4o2
823	CH3COOH	Acetic acid	ch3cooh
824	CH3OCHO	methyl formate	ch3ocho
825	CHOCH2OH	hydroxy acetaldehyde	haa
826	NH2COOH2+	Carbamic acid, O-protonated	nh2cooh2+
827	NH3COOH+	protonated Carbamic acid	nh3cooh+
828	H2OHCOOH	Water formic acid dimer 1	h2ohcooh_10
829	H2OHCOOH	Water formic acid dimer 2	h2ohcooh_11
830	HCOOHH2O	Formic acid water dimer	hcoohh2o
831	HOCH2OOH	hydroxy methyl peroxide	hoch2ooh
832	CH3COCH2	Acetonyl radical	ch3coch2
833	CH3CHNOH	Acetaldoxime	acetaldoxime
834	CH3CONH2	Acetamide	acetamide
835	HCONHCH3	N-methylformamide	nmfa
836	CH5N2O+	urea, N-protonated	ch4n2o+
837	H2NCOHNH2+	urea, protonated	ureah+
838	C2H5OO	ethylperoxy radical	c2h5oo
839	CH3NNCH3	(E)-1,2-Dimethyldiazene	dmdiaze
840	C3H5OH	Cyclopropanol	cproh
841	C3H6O	2-Propen-1-ol	c107186
842	C3H6O	Oxetane	oxetane
843	C3H6O	Propylene oxide	prox
844	CH3COCH3-	acetone anion	ch3coch3-
845	C3H6S	Thietane	thietane
846	C3H6S	Thiirane, methyl-	methiirane
847	CH3CSCH3	Thioacetone	ch3csch3
848	C2H6O2	1,2-Ethanediol	ethdiol
849	CH3OOCH3	dimethylperoxide	dmp
850	CH2SHCH2SH	1,2-Ethanedithiol	ethdisl
851	CH3SSCH3	Disulfide, dimethyl	ch3ssch3
852	CH3COHCH3+	acetone, protonated	acetoneh+
853	HOCH2CH2NH2	monoethanolamine	mea
854	CH3CHOHCH3	Isopropyl alcohol	isoproh
855	CH3OC2H5	Ethane, methoxy-	etome
856	C3H7SH	1-Propanethiol	prsh
857	CH3CHSHCH3	2-Propanethiol	isoprsh
858	CH3SCH2CH3	Ethane, (methylthio)-	etsme
859	H2OCH3OCH3	water dimethylether dimer	h2och3och3
860	Na2F2	Sodium Fluoride Dimer	na2f2
861	Na2Cl2	Disodium dichloride	na2cl2
862	C2F2	difluoroacetylene	c2f2
863	C2Cl2	dichloroacetylene	c2cl2
864	C2Cl2+	dichloroacetylene cation	c2cl2+
865	FNO2	Nitryl fluoride	fno2
866	FONO	Nitrosyl hypofluorite	fono
867	ClNO2	Nitryl chloride	clno2
868	ClONO	chlorine nitrite	clono
869	BrONO	Bromine nitrite	brono
870	N2F2	(Z)-Difluorodiazene	n2f2_z
871	N2F2	Dinitrogen difluoride, (E)-	n2f2_e
872	COFCl	Carbonic chloride fluoride	cofcl
873	CCl2O	Phosgene	cl2co
874	Cl2CS	Thiophosgene	cl2cs
875	COBr2	Carbonic dibromide	cobr2
876	BF3-	Borane, trifluoro- anion	bf3-
877	AlF2Cl	Aluminum chloride difluoride	alclf2
878	ScF3	Scandium trifluoride	ScF3
879	AlFCl2	Aluminum dichloride fluoride	alcl2f
880	AlCl3	Aluminum trichloride	alcl3
881	BBr3	Boron tribromide	bbr3
882	AlBr3	Aluminum Bromide	albr3
883	ClO3	Chlorine trioxide	clo3
884	ClO3-	chlorate anion	clo3-
885	BrO3-	Bromate anion	bro3-
886	CF3	Trifluoromethyl radical	cf3
887	CF3-	Trifluoromethyl anion	cf3-
888	CF3+	Trifluoromethyl cation	cf3+
889	SiF3	Silicon trifluoride radical	sif3
890	SiF3+	Silicon trifluoride cation	sif3+
891	CCl3	Trichloromethyl radical	ccl3
892	CCl3-	Trichloromethyl anion	ccl3-
893	CCl3+	Trichloromethyl cation	ccl3+
894	SiCl3	trichlorosilyl radical	sicl3
895	SiCl3+	trichlorosilyl cation	sicl3+
896	FOOF	Perfluoroperoxide	foof
897	F2SO	Thionyl Fluoride	f2so
898	ClOOCl	Dichlorine dioxide	cloocl
899	FSSF	Difluorodisulfane	fssf
900	S2F2	Thio-thionyl fluoride	s2f2
901	SOCl2	thionyl chloride	socl2
902	SeOCl2	selenium oxychloride	seocl2
903	NF3-	Nitrogen trifluoride anion	nf3-
904	NF3+	Nitrogen trifluoride cation	nf3+
905	PF3	Phosphorus trifluoride	pf3
906	AsF3	Arsenic trifluoride	asf3
907	PCl3	Phosphorus trichloride	pcl3
908	SbF3	Antimony Trifluoride	sbf3
909	AsCl3	Arsenous trichloride	ascl3
910	SbCl3	Antimony Trichloride	sbcl3
911	PBr3	Phosphorus tribromide	pbr3
912	AsBr3	Arsenic tribromide	asbr3
913	NI3	Nitrogen triiodide	ni3
914	PI3	Phosphorus triiodide	pi3
915	ClSSCl	Disulfur dichloride	s2cl2
916	SF3	Sulfur trifluoride	sf3
917	ClF3	Chlorine trifluoride	clf3
918	BrF3	Bromine trifluoride	brf3
919	IF3	iodone trifluoride	if3
920	CHF2Cl	difluorochloromethane	chf2cl
921	CHFCl2	fluorodichloromethane	chfcl2
922	CDCl3	trichloromethane-d	cdcl3
923	CHCl3	Chloroform	chcl3
924	SiHCl3	Trichlorosilane	sihcl3
925	CHF2I	difluoroiodomethane	chf2i
926	CHFClI	fluorochloroiodomethane	chfcli
927	CHCl2I	dichloroiodomethane	chcl2i
928	CHClBr2	Methane, dibromochloro-	chclbr2
929	CHBr3	bromoform	chbr3
930	CHI3	Iodoform	chi3
931	NF3H+	protonated nitrogen trifluoride	nf3h+
932	C2H2F2	Ethene, 1,2-difluoro-, (E)-	c2h2f2e
933	C2H2F2	Ethene, 1,2-difluoro-, (Z)-	c2h2f2z
934	CH2CF2	Ethene, 1,1-difluoro-	ch2cf2
935	CH2CCl2	Ethene, 1,1-dichloro-	ch2ccl2
936	CHClCHCl	Ethene, 1,2-dichloro-, (E)-	chclchcle
937	CHClCHCl	Ethene, 1,2-dichloro-, (Z)-	chclchclz
938	C2H2Br2	1,1-dibromoethene	c2h2br2
939	CH2FCHO	Fluoroacetaldehyde	ch2fcho
940	CH3COF	Acetyl fluoride	ch3cof
941	CH2ClCHO	chloroacetaldehyde	ch2clcho
942	CH3COCl	Acetyl Chloride	ch3cocl
943	CH2FCH2Cl	Ethane, 1-chloro-2-fluoro-	ch2fch2cl
944	CH3CHFCl	Ethane, 1-chloro-1-fluoro-	ch3chfcl
945	CH2ClCH2Cl	Ethane, 1,2-dichloro-	ch2clch2cl
946	CH3CHCl2	Ethane, 1,1-dichloro-	ch3chcl2
947	CH2CFCH3	2-fluoropropene	2fpro
948	C3H5Cl	1-Propene, 3-chloro-	prop1cl3
949	C3H5Cl	1-chloro-1-propene(E)	prop1cl1e
950	C3H5Cl	1-chloro-1-propene(Z)	prop1cl1z
951	CH2ClCH2OH	2-Chloroethanol	ch2clch2oh
952	CH2ClCH2OH2+	2-chloroethanol, protonated	ch2clch2oh2+
953	CH2ClCH2CH3	Propane, 1-chloro-	prcl1
954	CH3CH2CH2Br	n-propyl bromide	prbr
955	CH3CHBrCH3	i-propyl bromide	iprbr
956	C3H9O+	trimethyl oxonium cation	c3h9o+
957	C5H5	cyclopentadienyl radical	c5h5
958	C5H5-	cylopentadienyl anion	c5h5-
959	C5H6	1,3-Cyclopentadiene	c542927
960	C5H6	1-Buten-3-yne, 2-methyl-	c78808
961	C5H6	3-Penten-1-yne, (E)-	c2004695
962	C5H6	3-Penten-1-yne, (Z)-	c1574409
963	C5H6	Bicyclo[2.1.0]pent-2-ene	c5164352
964	C5H6	Cyclopropylacetylene	c6746947
965	C5H7	1,3-pentadienyl radical	pdyl
966	C5H7	cyclopentenyl radical	cpyl
967	C5H8	1,2-Butadiene, 3-methyl-	c598254
968	C5H8	1,2-Pentadiene	c591957
969	C5H8	1,3-Butadiene, 2-methyl-	c78795
970	C5H8	1,3-Pentadiene, (E)-	c2004708
971	C5H8	1,3-Pentadiene, (Z)-	c1574410
972	C5H8	1,4-Pentadiene	c591935
973	C5H8	1-pentyne	a1pentyne
974	C5H8	2,3-Pentadiene	c591968
975	C5H8	Cyclobutane, methylene-	c1120565
976	C5H8	Cyclopentene	c142290
977	C5H8	Ethenylcyclopropane	c693867
978	CH3CCCH2CH3	2-Pentyne	2pentyne
979	C5H10	1-Butene, 2-methyl-	c563462
980	C5H10	2-Butene, 2-methyl-	c513359
981	C5H10	2-Pentene, (E)-	c646048
982	C5H10	2-Pentene, (Z)-	c627203
983	C5H10	Cyclopentane	c287923
984	C5H10	Cyclopropane, 1,1-dimethyl-	c1630940
985	CH2CHCH2CH2CH3	1-pentene	pentene
986	C5H11	2-Methylbut-2-yl radical	c4348350
987	C5H12	Butane, 2-methyl-	buta2
988	C5H12	Pentane	pentane
989	C5H12	Propane, 2,2-dimethyl-	neopentane
990	Si(CH3)4	tetramethylsilane	tms
991	N2O3	Dinitrogen trioxide	n2o3
992	C3H2N2	Malononitrile	c3h2n2
993	CH2N4	1H-Tetrazole	1htz
994	C3H3N2	imidazolyl radical	im
995	C3H3N2-	imidizolyl anion	im-
996	C2H3N3	1H-1,2,4-Triazole	c288880
997	C4H4N	pyrrolide radical	c4h4n
998	C4H4N-	pyrrolide anion	c4h4n-
999	C3H4N2	1H-Imidazole	1himidaz
1000	C3H4N2	1H-Pyrazole	1hpyraz
1001	C3H4N2	4H-Imidazole	imid4h
1002	C4H5N	(E)-2-Butenenitrile	c627269
1003	C4H5N	(Z)-2-Butenenitrile	c1190767
1004	C4H5N	2H-pyrrole	pyrrole2
1005	C4H5N	3H-pyrrole	pyrrole3
1006	C4H5N	Cyclopropanecarbonitrile	c5500210
1007	CH2CHCH2CN	Allylcyanide	ch2chch2cn
1008	C4H6N+	pyrrole, alpha-protonated	appyr
1009	C4H6N+	pyrrole, beta-protonated	bppyr
1010	C4H6N+	pyrrole, protonated	ppyr
1011	C3H6N2	3-Aminopropionitrile	c151188
1012	CH3CH(CH3)CN	Propanenitrile, 2-methyl-	c4h7n
1013	CH3CH2CH2CN	Butanenitrile	c109740
1014	C5H8	Bicyclo[2.1.0]pentane	c185944
1015	C5H8	Spiropentane	c157404
1016	C4H9N	Cyclobutylamine	cbam
1017	C4H9N	Pyrrolidine	pyrrolidine
1018	C3H10N2	1,2-Diaminopropane	diampr12
1019	C(CH3)3NH2	2-Propanamine, 2-methyl-	c75649
1020	C(NH2)H2C(CH3)HCH3	1-Propanamine, 2-methyl-	c78819
1021	C(NH2)H2CH2CH2CH3	1-Butanamine	butam1
1022	CH3C(NH2)HCH2CH3	2-Butanamine	butam2
1023	NH(C2H5)2	diethylamine	dea
1024	NC4H12+	tetramethyl ammonium cation	nc4h12+
1025	C3O2+	Carbon suboxide cation	c3o2+
1026	MgCO3	Magnesium Carbonate	mgco3
1027	BeCO3	Beryllium Carbonate	beco3
1028	CaCO3	Calcium Carbonate	caco3
1029	ONONO	Nitrosyl nitrite	onono
1030	PO4---	phosphate	po4---
1031	SO4--	sulfate	so4--
1032	HOONO2	peroxy nitric acid	hoono2
1033	HSO4-	bisulfate anion	hso4-
1034	C2H2N2S	1,3,4-Thiadiazole	c2h2n2s
1035	C3H2O2	Propiolic acid	c3h2o2
1036	CHOCOOH	oxo acetic acid	oaa
1037	H2SO4	Sulfuric acid	h2so4
1038	H2SeO4	Selenic acid	h2seo4
1039	C3H3NO	Oxazole	oxazole
1040	CH3C(O)OO	acetyl peroxy radical	ch3coo2
1041	CH3NO3	Methyl nitrate	ch3no3
1042	H3PO4	Phosphoric Acid	h3po4
1043	C4H4O	Furan	furan
1044	C4H4O+	Furan cation	furan+
1045	C4H4S	Thiophene	furans
1046	C3H4O2	β–Propiolactone	beta
1047	C3H4O2	2-Propenoic acid	propenoic2
1048	C3H4O2	Methyl glyoxal	megly
1049	C3H4O2	propanedial	propanedial
1050	C3H4O2	propenalol	propenalol
1051	HOCHCCHOH	allenediol	aldiol
1052	C2H4O3	1,2,3-trioxolane	c2h4o3
1053	C2H4O3	trioxolane124	triox
1054	HOCH2COOH	Hydroxyacetic acid	hac
1055	CH2CHCONH2	Acrylamide	c79061
1056	CH3OCH2CN	Methoxyacetonitrile	c1738369
1057	CH5N3S	Hydrazinecarbothioamide	c79196
1058	H2NCH2COOH	Glycine	glycine
1059	CH3SO2NH2	methanesulfonamide	ch3so2nh2
1060	C4H6O	cis-2-butenal	butenal2c
1061	C4H6O	Cyclobutanone	cbutone
1062	C4H6O	Furan, 2,3-dihydro-	furan23h
1063	C4H6O	Furan, 2,5-dihydro-	furan25h
1064	CH2CHOCHCH2	Vinyl ether	vinylether
1065	CHOCHCHCH3	2-Butenal	butenal2
1066	C4H6S	Thiophene, 2,3-dihydro-	thiop23h
1067	C4H6S	Thiophene, 2,5-dihydro-	thiop25h
1068	CH2CHSCHCH2	Divinyl sulfide	divis
1069	C2H6N2O	Urea, methyl-	c598505
1070	C3H6O2	1,3-Dioxolane	dioxolane
1071	CH3CH2COOH	Propanoic Acid	propanoic
1072	CH3COOCH3	methyl acetate	aame
1073	CH3SSSCH3	dimethyl trisulfide	c2h6s3
1074	C3H7NO	dimethylformamide	dmf
1075	C3H7NO	Propanamide	propanam
1076	C2H3OC2H5	Ethene, ethoxy-	c109922
1077	C4H8O	Cyclobutanol	c2919235
1078	C4H8O	Furan, tetrahydro-	thf
1079	CH2C(CH3)OCH3	1-Propene, 2-methoxy-	pre1meo2
1080	CH3COCH2CH3	2-Butanone	buta2one
1081	CHOCH(CH3)CH3	Propanal, 2-methyl-	c78842
1082	CHOCH2CH2CH3	Butanal	butanal
1083	C3H8O2	1,3-Propanediol	c504632
1084	C3H8O2	Hydroperoxide, 1-methylethyl	c3031752
1085	C3H8O2	Methane, dimethoxy-	c109875
1086	C3H8O2	Propylene glycol	c57556
1087	C3H8S2	1,3-Propanedithiol	c109808
1088	C4H10O	1-Butanol	butanol1
1089	C4H10O	1-Propanol, 2-methyl-	c78831
1090	C4H10O	2-Butanol, (.+/-.)-	butanol2
1091	C4H10O	Ethanol, 1,1-dimethyl-	tbuoh
1092	C4H10O	Propane, 2-methoxy-	c598538
1093	C4H10O+	1-Butanol cation	butanol1+
1094	C2H5SC2H5	Diethyl sulfide	etset
1095	CH2(SH)CH(CH3)CH3	1-Propanethiol, 2-methyl-	c513440
1096	CH3C(SCH3)HCH3	Propane, 2-(methylthio)-	mesipr
1097	CH3CH(SH)CH2CH3	2-Butanethiol	butansl2
1098	FNO3	Fluorine nitrate	fno3
1099	ClONO2	Chlorine nitrate	clono2
1100	BrONO2	Bromine nitrate	brono2
1101	TiCl4	Titanium tetrachloride	ticl4
1102	ClO4-	perchlorate anion	clo4-
1103	BF4-	tetrafluoroboron anion	bf4-
1104	ClFO3	Perchloryl fluoride	clfo3
1105	SO2F2	Sulfuryl fluoride	so2f2
1106	SO2Cl2	Sulfuryl chloride	so2cl2
1107	F3NO	Nitrogen trifluoride oxide	f3no
1108	F3PO	Phosphoryl fluoride	pf3o
1109	Cl3PO	Phosphoryl chloride	pcl3o
1110	CF4	Carbon tetrafluoride	cf4
1111	SiF4	Silicon tetrafluoride	sif4
1112	TiF4	Titanium tetrafluoride	tif4
1113	CFCl3	Trichloromonofluoromethane	cfcl3
1114	CCl4+	Carbon tetrachloride cation	ccl4+
1115	CBrClF2	Methane, bromochlorodifluoro-	cbrclf2
1116	SiCl4	Silane, tetrachloro-	sicl4
1117	CF3I	trifluoroiodomethane	cf3i
1118	CBrCl3	Methane, bromotrichloro-	cbrcl3
1119	CBr2F2	Methane, dibromodifluoro-	cbr2f2
1120	GeCl4	Germanium Tetrachloride	gecl4
1121	CCl3I	trichloroiodomethane	ccl3i
1122	CFBr3	fluorotribromomethane	cfbr3
1123	CFClBrI	fluorochlorobromoiodomethane	cfclbri
1124	CF2I2	difluorodiiodomethane	cf2i2
1125	CCl2I2	dichlorodiiodomethane	ccl2i2
1126	SiBr4	Silicon tetrabromide	sibr4
1127	CBr3I	tribromoiododmethane	cbr3i
1128	CI4	tetraiodomethane	ci4
1129	SiI4	silicon tetraiodide	sii4
1130	ClOF3	Chlorine trifluoride oxide	clof3
1131	C2HF3	Trifluoroethylene	c2hf3
1132	C2HF3+	Trifluoroethylene cation	c2hf3+
1133	CHClCCl2	Trichloroethylene	chclccl2
1134	CHBrCF2	1-Bromo-2,2-difluoroethylene	chbrcf2
1135	HClO4	perchloric acid	hclo4
1136	HSO3F	Fluorosulfonic acid	hso3f
1137	CF3OH	trifluoromethanol	cf3oh
1138	CHClCCHCl	1,3-dichloroallene	chclcchcl
1139	PF3CH2	phosphorane, trifluoromethylene-	pf3ch2
1140	CH3CF3	Ethane, 1,1,1-trifluoro-	ch3cf3
1141	CH3CF2Cl	1-Chloro-1,1-Difluoroethane	ch3cf2cl
1142	CH3CFCl2	1,1-Dichloro-1-fluoroethane	ch3cfcl2
1143	CH2ClCHCl2	1,1,2-trichloroethane	ch2clchcl2
1144	CH3CCl3	Ethane, 1,1,1-trichloro-	ch3ccl3
1145	SiCl3CH3	methyltrichlorosilane	sicl3ch3
1146	CH3CBr3	1,1,1-tribromoethane	ch3cbr3
1147	NH3BCl3	Amminetrichloroboron	nh3bcl3
1148	SiH3CCl3	(trichloromethyl)silane	sih3ccl3
1149	C3H5ClO	Oxirane, (chloromethyl)-	c106898
1150	CH3CF2CH3	2,2-difluoropropane	ch3cf2ch3
1151	CH2ClCH2CH2Cl	1,3-dichloropropane	prdicl13
1152	CH2ClCHClCH3	Propane, 1,2-dichloro-	prdicl12
1153	CHCl2CH2CH3	1,1-dichloropropane	prdicl11
1154	SiCl2(CH3)2	dichlorodimethylsilane	sicl2me2
1155	CH2CClCH2CH3	1-Butene, 2-chloro-	bute1cl2
1156	CH2CHCH2CH2Cl	1-Butene, 4-chloro-	bute1cl4
1157	CH2CHCHClCH3	1-Butene, 3-chloro-	bute1cl3
1158	CH2ClCHCHCH3	2-Butene, 1-chloro-	bute2cl1
1159	CH3CClCHCH3	2-Butene, 2-chloro-, (E)-	bute2cl2e
1160	CH3CClCHCH3	2-Butene, 2-chloro-, (Z)-	bute2cl2z
1161	CHClCHCH2CH3	(E)-1-Chloro-1-butene	bute1cl1
1162	CHClCHCH2CH3	(Z)-1-Chloro-1-butene	bute1cl1z
1163	C4H9F	1-fluorobutane	butaf1
1164	CH3CHFCH2CH3	2-fluorobutane	butaf2
1165	CH2ClCH2CH2CH3	Butane, 1-chloro-	butacl1
1166	CH3CCl(CH3)CH3	Propane, 2-chloro-2-methyl-	procl2me2
1167	CH3CHClCH2CH3	Butane, 2-chloro-	butacl2
1168	XeF4	Xenon tetrafluoride	xef4
1169	CF3PH2	phosphine, (trifluoromethyl)-	cf3ph2
1170	NH3BF3	Amminetrifluoroboron	nh3bf3
1171	C6H2	hexatriyne	c6h2
1172	C6H4	(E)-Hexa-1,5-diyne-3-ene	c6h4e
1173	C6H4	(Z)-Hexa-1,5-diyne-3-ene	c6h4z
1174	C6H4	Benzyne	benzyne
1175	C6H5	phenyl	phenyl
1176	C6H5-	phenyl anion	phenyl-
1177	C6H6	2,4-Hexadiyne	hexadiyne
1178	C6H6	3,4-Dimethylenecyclobutene	cb34m
1179	C6H6	Hexa-1,5-diene-3-yne	hdy153
1180	C6H6	Trimethylenecycopropane	tmcp
1181	C6H6+	Benzene cation	c6h6+
1182	C6H7+	benzene, protonated	c6h7+
1183	C6H8	(E)-hexa-1,3,5-triene	c821078
1184	C6H8	(E)-hexa-2,3,4-triene	c59660650
1185	C6H8	(Z)-hexa-1,3,5-triene	hexatri135
1186	C6H8	(Z)-hexa-2,3,4-triene	hetr234c
1187	C6H8	1,3-Cyclohexadiene	cyhexadiene13
1188	C6H8	1,4-Cyclohexadiene	cyhexadiene14
1189	C6H8	3-Methylenecyclopentene	c930267
1190	C6H8	Bicyclo[2.1.1]hex-2-ene	c822413
1191	C6H8	Bicyclo[2.2.0]hex-1(4)-ene	c30830207
1192	C6H8	Bicyclo[3.1.0]hex-2-ene	c694019
1193	C6H10	1,3-Hexadiene, (E)-	hexdi13e
1194	C6H10	1,3-Hexadiene, (Z)-	hexdi13z
1195	C6H10	1,4-Hexadiene, (E)-	hexdi14t
1196	C6H10	1,4-Hexadiene, (Z)-	hexdi14z
1197	C6H10	1,5-Hexadiene	c592427
1198	C6H10	1-Butyne, 3,3-dimethyl-	c917920
1199	C6H10	1-Hexyne	hexyne1
1200	C6H10	2,4-Hexadiene, (E,E)-	hexdi24ee
1201	C6H10	2,4-Hexadiene, (E,Z)-	hexdi24ez
1202	C6H10	2,4-Hexadiene, (Z,Z)-	hexdi24zz
1203	C6H10	2-Hexyne	c764352
1204	C6H10	3-Hexyne	hexyne3
1205	C6H10	cyclohexene	cyclohexene
1206	C6H10	Cyclopentene, 1-methyl-	c693890
1207	C6H10	Cyclopentene, 3-methyl-	c1120623
1208	C6H10	Cyclopentene, 4-methyl-	c1759815
1209	C4H6(CH3)2	1,1-dimethylcyclobutane	dmcb11
1210	C6H12	(1R,2R)-1,2-dimethylcyclobutane	dmcb12t
1211	C6H12	(1r,3r)-1,3-dimethylcyclobutane	dmcb13t
1212	C6H12	(E)-2-Hexene	e2hexene
1213	C6H12	(E)-3-methylpent-2-ene	c616126
1214	C6H12	(E)-hex-3-ene	e3hexene
1215	C6H12	(Z)-3-methylpent-2-ene	c922623
1216	C6H12	(Z)-hex-2-ene	z2hexene
1217	C6H12	(Z)-hex-3-ene	z3hexene
1218	C6H12	2,3-dimethylbut-1-ene	c563780
1219	C6H12	2,3-dimethyl-but-2-ene	tmeet
1220	C6H12	3-methylenepentane	c760214
1221	C6H12	cis-1,2-dimethylcyclobutane	dmcb12c
1222	C6H12	cis-1,3-dimethylcyclobutane	dmcb13c
1223	C6H12	Cyclohexane	cyclohexane
1224	C6H12	Cyclopentane, methyl-	c96377
1225	C6H12	Ethylcyclobutane	c4806615
1226	C6H12	hex-1-ene	hexene1
1227	C6H14	Butane, 2,2-dimethyl-	buta22
1228	C6H14	Butane, 2,3-dimethyl-	buta23
1229	C6H14	Hexane	hexane
1230	C6H14	Pentane, 2-methyl-	penta2
1231	C6H14	Pentane, 3-methyl-	penta3
1232	C4N2	2-Butynedinitrile	c4n2
1233	C4H2N2	Fumaronitrile	c4h2n2
1234	C2H2N4	sym-tetrazine	ttz
1235	C3H3N3	1,3,5-Triazine	triazine135
1236	CH3N5	5-Aminotetrazole	c4418615
1237	C4H4N2	1,3-Diazine	diazine13
1238	C4H4N2	Pyrazine	pyrazine
1239	C4H4N2	Pyridazine	pyridazine
1240	C4H4N2	Succinonitrile	c110612
1241	C2H4N4	1H-Tetrazole, 1-methyl-	c16681779
1242	C2H4N4	1H-Tetrazole, 5-methyl-	c4076362
1243	C2H4N4	2H-Tetrazole, 2-methyl-	c16681780
1244	C5H5N	Bicyclo[1.1.0]butane-1-carbonitrile	bibucn
1245	C5H5N	E-2,4-pentadienenitrile	bdcn
1246	C5H5N	Pyridine	pyridine
1247	B3N3H6	borazine	borazine
1248	C6H6	Fulvene	fulvene
1249	C5H6N+	Pyridinium	c5h6n
1250	C4H6N2	1H-Imidazole, 2-methyl-	c693981
1251	C5H7N	(E)-2-Pentenenitrile	c26294984
1252	C5H7N	(E)-3-Pentenenitrile	c16529661
1253	C5H7N	(Z)-2-Pentenenitrile	c25899507
1254	C5H7N	1H-Pyrrole, 1-methyl-	c96548
1255	C5H7N	Cyclobutanecarbonitrile	c4426113
1256	C5H9N	1,2,3,6-Tetrahydropyridine	c694053
1257	C5H9N	Butanenitrile, 2-methyl-	c18936179
1258	C5H9N	Pentanenitrile	c110598
1259	C5H9N	Propanenitrile, 2,2-dimethyl-	c630182
1260	C6H10	Bicyclo[3.1.0]hexane	c285585
1261	C5H11N	Cyclopentanamine	cypentam
1262	C5H11N	Piperidine	piper
1263	C4H12N2	1,2-Butanediamine	c4426486
1264	C4H12N2	2-Methyl-1,2-propanediamine	c811938
1265	Li2CO3	Lithium Carbonate	li2co3
1266	Na2CO3	Sodium Carbonate	na2co3
1267	C2O4--	oxalate anion	c2o4
1268	MgSO4	Magnesium Sulfate	mgso4
1269	N2O4	Dinitrogen tetroxide	n2o4
1270	C2H2O4	Oxalic Acid	oxalic
1271	C2H3NO3	Oxamic acid	oxamic
1272	C4H4O2	2(5H)-Furanone	furanone
1273	C4H4O2	2-Oxetanone, 4-methylene-	c674828
1274	C2H4N2O2	Oxalamide	oxalamide
1275	C2H4N2S2	Ethanedithioamide	c79403
1276	C2H4CO3	Ethylene carbonate	etco3
1277	C3H4O2S	2H-Thiete-1,1-dioxide	c7285327
1278	C3H4S3	1,3-Dithiolane-2-thione	c822388
1279	C2H4O4	Formic acid dimer	fadimer
1280	C4H5NO	3-Methylisoxazole	isox3m
1281	C4H5NO	Isoxazole, 5-methyl-	c5765446
1282	C4H5NS	4-Methylthiazole	c693958
1283	C2H5NO3	Nitric acid, ethyl ester	c625581
1284	C5H6O	2-methylfuran	furan2m
1285	C5H6O	3-Methylfuran	furan3m
1286	C5H6S	Thiophene, 2-methyl-	c554143
1287	C5H6S	Thiophene, 3-methyl-	c616444
1288	C4H6O2	2,3-Butanedione	c431038
1289	C4H6O2	2-Propenoic acid, methyl ester	c96333
1290	C4H6O2	Crotonic Acid	crot
1291	C4H6OS	2,3-dihydrothiophene-2-ol	c9000117
1292	C4H6OS	2,5-dihydrothiophene-3-ol	c9000093
1293	C4H6OS	4,5-dihydrothiophene-2-ol	c9000106
1294	C4H6OS	4,5-dihydrothiophene-3-ol	c9000082
1295	C4H6OS	Dihydro-2-(3H)-thiophenone	c1003107
1296	C4H6OS	Dihydro-3-(2H)-thiophenone	c1003049
1297	C4H6OS	Vinyl sulfoxide	c1115157
1298	CH6N4S	Carbonothioic dihydrazide	thiacarb
1299	C2H6N2O2	(E)-Azodioxymethane	c37765154
1300	C2H6N2O2	Dimethylnitroamine	c4164287
1301	C3H6S3	1,3,5-Trithiane	c3h6s3
1302	C3H6S3	Carbonotrithioic acid, dimethyl ester	c2314489
1303	C2H6O3S	Sulfurous acid, dimethyl ester	c616422
1304	C4H7NO	2-Pyrrolidinone	c616455
1305	C4H7NO	Ethoxyacetonitrile	etoaccn
1306	C4H7NO	Methacrylamide	c79390
1307	C4H7NO	Oxazole, 4,5-dihydro-2-methyl-	c1120645
1308	HCONH2CN2H4	formamide aminomethanimine dimer	d13
1309	C3H7ONO	Propyl nitrite	prono
1310	CH3CH(CH3)ONO	Isopropyl nitrite	c541424
1311	CH3CH(NH2)COOH	Alanine	alanine
1312	CH3NHCH2COOH	Sarcosine	sarcosine
1313	NH2CH2CH2COOH	β–alanine	betaalanine
1314	NH2COOC2H5	Urethane	urethane
1315	C5H8O	2H-Pyran, 3,4-dihydro-	c110872
1316	C5H8O	Cyclopentanone	c120923
1317	C5H8O	Furan, 2,3-dihydro-5-methyl-	c1487156
1318	C5H8O	Methyl cyclopropyl ketone	c765435
1319	N(CH3)2CONH2	Urea, N,N-dimethyl-	c598947
1320	NH(CH3)CONH(CH3)	Urea, N,N'-dimethyl-	c96311
1321	NH2CONHC2H5	Urea, ethyl-	c625525
1322	C4H8O2	1,3-Dioxane	dioxan13
1323	C4H8O2	1,3-Dioxolane, 2-methyl-	c497267
1324	C4H8O2	1,4-Dioxane	dioxan14
1325	C4H8O2	Ethene, 1,1-dimethoxy-	c922690
1326	C4H8OS	s-Ethyl thioacetate	c625605
1327	C3H8O3	1,2,3-Propanetriol	glycerin
1328	C3H8O2S	(Methylsulfonyl)ethane	c594434
1329	C4H9NO	Butanamide	c541355
1330	C4H9NO	Propanamide, 2-methyl-	c563837
1331	C5H10O	2-Butanone, 3-methyl-	c563804
1332	C5H10O	2H-Pyran, tetrahydro-	c142687
1333	C5H10O	2-methylbutyraldehyde	2meba
1334	C5H10O	2-Pentanone	mpk
1335	C5H10O	Cyclopentanol	c96413
1336	C5H10O	Oxetane, 3,3-dimethyl-	c6921353
1337	C5H10O	Pentanal	pal
1338	C5H10S	2H-Thiopyran, tetrahydro-	c1613510
1339	C5H10S	3-Ethylthio-1-propene	c5296628
1340	C5H10S	Cyclopentanethiol	c1679078
1341	C5H10S	Thiophene, tetrahydro-2-methyl-	c1795091
1342	C5H10S	Thiophene, tetrahydro-3-methyl-	c4740005
1343	C4H10O2	1,1-Dimethoxyethane	c534156
1344	C4H10O2	1,3-Butanediol	budiol13
1345	C4H10O2	1,4-Butanediol	budiol14
1346	C4H10O2	Ethane, 1,2-dimethoxy-	c110714
1347	C4H10OS	Diethyl sulfoxide	c70291
1348	C4H10S2	1,4-Butanedithiol	budisl14
1349	C4H11NO	Diethylhydroxylamine	c3710847
1350	C5H12O	1-Butanol, 2-methyl-	c137326
1351	C5H12O	1-Butanol, 3-methyl-	c123513
1352	C5H12O	1-Pentanol	pentanol1
1353	C5H12O	2-Butanol, 3-methyl-	c598754
1354	C5H12O	2-Pentanol	peol2
1355	C5H12O	3-Pentanol	pentan3ol
1356	C5H12O	Butane, 1-methoxy-	meobu
1357	C5H12O	Propane, 1-ethoxy-	proet
1358	C5H12O	Propane, 2-methoxy-2-methyl-	c1634044
1359	C5H12S	1-Butanethiol, 2-methyl-	c1878188
1360	C5H12S	1-Butanethiol, 3-methyl-	c541311
1361	C5H12S	1-Pentanethiol	c110667
1362	C5H12S	1-Propanethiol, 2,2-dimethyl-	c1679089
1363	C5H12S	2-Butanethiol, 2-methyl-	c1679090
1364	C5H12S	2-Butanethiol, 3-methyl-	c2084186
1365	C5H12S	Butane, 1-(methylthio)-	c628295
1366	C5H12S	Ethyl propyl sulfide	c4110503
1367	C5H12S	Propane, 2-(ethylthio)-	c5145993
1368	C5H12S	Propane, 2-methyl-2-(methylthio)-	c6163640
1369	ClCOClCO	Oxalyl chloride	oxcl
1370	CF3CN	Acetonitrile, trifluoro-	cf3cn
1371	CF3CN+	Acetonitrile, trifluoro- cation	cf3cn+
1372	B2F4	Diboron tetrafluoride	b2f4
1373	B2Cl4	Diboron tetrachloride	b2cl4
1374	C2F4	Tetrafluoroethylene	c2f4
1375	C2F4+	Tetrafluoroethylene cation	c2f4+
1376	CF2CCl2	difluorodichloroethylene	cf2ccl2
1377	CFClCClF	trans-1,2-dichloro-1,2-difluoroethylene	cfclcclf
1378	CFClCFCl	cis-1,2-dichloro-1,2-difluoroethylene	cfclcfcl
1379	C2FCl3	fluorotrichloroethene	c2fcl3
1380	C2Cl4	Tetrachloroethylene	c2cl4
1381	CF3OF	Trifluoromethylhypofluorite	cf3of
1382	SOF4	Sulfur tetrafluoride oxide	sof4
1383	AsF5	Arsenic pentafluoride	asf5
1384	PCl5	Phosphorus pentachloride	pcl5
1385	SF5	Sulfur pentafluoride	sf5
1386	SF5+	pentafluoro sulfur cation	sf5+
1387	SbCl5	Antimony pentachloride	sbcl5
1388	BrF5	bromine pentafluoride	brf5
1389	ClF5	chlorinepentafluoride	clf5
1390	IF5	pentafluoroiodine	if5
1391	CF3CHO	trifluoroacetaldehyde	cf3cho
1392	CCl3CHO	trichloroacetaldehyde	ccl3cho
1393	CHFClCHClF	ethane, 1,2-dichloro-1,2-difluoro-	chfclchclf
1394	CF3CH2F	1,1,1,2-tetrafluoroethane	cf3ch2f
1395	CHF2CHF2	1,1,2,2-tetrafluoroethane	chf2chf2
1396	CF3CH2Cl	2,2,2-Trifluoroethyl chloride	cf3ch2cl
1397	CHFClCHFCl	1,2-dichloro-1,2-difluoroethane RR	chfclchfcl
1398	CH2ClCCl3	1,1,1,2-tetrachloroethane	ch2clccl3
1399	CHCl2CHF2	1,1-dichloro-2,2-difluoroethane	c2h2cl2f2
1400	CF3COOH	trifluoroacetic acid	cf3cooh
1401	C4H3ClO	Furan, 2-chloro	fur2cl
1402	C4H3ClO	Furan,3-chloro	fur3cl
1403	C3H5ClO2	Carbonochloridic acid, ethyl ester	c541413
1404	C3H5Cl3	Propane, 1,2,3-trichloro-	prcl135
1405	C4H8Cl2	1,4-Dichlorobutane	c110565
1406	C4H8Cl2	Butane, 1,2-dichloro-	c616217
1407	C4H8Cl2	Butane, 1,3-dichloro-	c1190223
1408	C4H8Cl2	Butane, 2,3-dichloro-, (r*,r*)-(.+/-.)-	c2211678
1409	C4H8Cl2	Butane, 2,3-dichloro-, (r*,s*)-	c4028562
1410	C4H9ClO	1-Chloro-2-ethoxyethane	c628342
1411	C5H11Cl	Pentane, 1-chloro-	pencl1
1412	C4H8O2	Butanoic acid	bua
1413	C6H5CH2	benzyl radical	benzyl
1414	C6H5CH3	toluene	toluene
1415	C7H8	cycloheptatriene	cht
1416	C7H8	Norbornadiene	norbor
1417	C7H8	Quadricyclane	qucy
1418	C7H12	Norbornane	nor
1419	C7H14	cycloheptane	c7h14
1420	C7H16	2-methylhexane	2mhex
1421	C7H16	3-methylhexane	hex3m
1422	C7H16	heptane	heptane
1423	C6H7N	2-Methylpyridine	mp
1424	C6H5NH2	aniline	aniline
1425	C6H13N	2-Methylpiperidine	pip2m
1426	C6H13N	cyclohexanamine	cham
1427	C6H15N	triethylamine	tea
1428	N2O5	Dinitrogen pentoxide	n2o5
1429	C4H2O3	Maleic Anhydride	malan
1430	C5H4O2	4-Cyclopentene-1,3-dione	cpdio
1431	C6H5O	phenoxy radical	phenoxy
1432	C5H5NO	2(1H)-Pyridinone	c72762006
1433	C5H5NO	2(3H)-Pyridinone	c9000048
1434	C5H5NO	2(5H)-Pyridinone	c9000037
1435	C5H5NO	2-Pyridinol	c109104
1436	C5H5NO	3(2H)-Pyridinone	c9000004
1437	C5H5NO	3(4H)-Pyridinone	c9000026
1438	C5H5NO	3(6H)-Pyridinone	c9000015
1439	C5H5NO	3-Pyridinol	c109002
1440	C5H5NO	4(1H)-Pryidinone	c9000060
1441	C5H5NO	4(3H)-Pryidinone	c9000059
1442	C5H5NO	4-Pyridinol	c626642
1443	C6H5OH	phenol	phenol
1444	C6H6O	2,4-Cyclohexadienone	c24599573
1445	C6H6O	2,5-Cyclohexadienone	c5664335
1446	C6H5SH	Benzenethiol	phsh
1447	HO2CCHNH2CH2OH	Serine	serine
1448	C5H8O2	Acetylacetone	acac
1449	C4H8O2S	Sulfolane	sulfolane
1450	C7H10	Norbornene	norbornene
1451	CH(C2H3)3	trivinyl methane	tvm
1452	C6H10O	cyclohexanone	chexo
1453	C6H12O	hexanal	c6h12o
1454	C3H7OC3H7	di-n-propyl ether	propr
1455	CF3COO-	trifluoro acetate anion	cf3coo-
1456	CF3COF	trifluoroacetyl fluoride	cf3cof
1457	CF3COCl	trifluoroacetyl chloride	cf3cocl
1458	PF6	Hexafluorophosphate neutral	pf6
1459	PF6-	Hexafluorophosphate ion	pf6-
1460	SeF6	Selenium hexafluoride	sef6
1461	SF5Cl	sulfur chloropentafluoride	sf5cl
1462	CF3CHF2	pentafluoroethane	cf3chf2
1463	CF3CHFCl	1,1,1,2-tetrafluorochloroethane	cf3chfcl
1464	CF3CHCl2	1,1-Dichloro-2,2,2-trifluoroethane	cf3chcl2
1465	CHCl2CClF2	Ethane, 1,2,2-trichloro-1,1-difluoro-	chcl2cclf2
1466	CCl3CHCl2	pentachloroethane	ccl3chcl2
1467	C6H5F	Fluorobenzene	bzf
1468	C6H5Cl	chlorobenzene	bzcl
1469	C6H5Br	bromobenzene	bzbr
1470	C8H6	Calicene	calicene
1471	C6H5CCH	phenylacetylene	phac
1472	C8H6	benzocyclobutadiene	bcbd
1473	C8H6	Pentalene	pentalene
1474	C6H5CHCH2	Styrene	styrene
1475	C8H8	cyclooctatetraene	cot
1476	C6H5CH2CH3	Ethylbenzene	etbz
1477	CH3C6H4CH3	meta-xylene	mxylene
1478	CH3C6H4CH3	paraxylene	pxylene
1479	C8H14	Bicyclo[2.2.2]octane	bico222
1480	C8H16	cyclooctane	cyclooct
1481	(CH3)3CC(CH3)3	tetramethylbutane	tmb
1482	C8H18	Octane	c8h18
1483	C6H5CN	phenyl cyanide	phcn
1484	C6H12N2	Triethylenediamine	ted
1485	C4O4--	squarate dianion	c4o4--
1486	S8	Octasulfur	s8
1487	C6H4O2	parabenzoquinone	pbq
1488	C4H4N2O2	Uracil	uracil
1489	C6H5OCH3	Anisole	anisole
1490	C5H9NO2	Proline	proline
1491	C6H12O2	Methyl pivalate	c598981
1492	C6H12O2	Hexanoic acid	hexa
1493	C4F4	tetrafluorcyclobutadiene	c4f4
1494	Al2Cl6	Aluminum, di-μ-chlorotetrachlorodi-	al2cl6
1495	CF3CF2Cl	pentafluorochloroethane	cf3cf2cl
1496	CF2ClCF2Cl	1,2-Dichloro-1,1,2,2-tetrafluoroethane	cf2clcf2cl
1497	CF3CFCl2	1,1-Dichlorotetrafluoroethane	cf3cfcl2
1498	CF2ClCFCl2	Ethane, 1,1,2-trichloro-1,2,2-trifluoro-	cf2clcfcl2
1499	CF3CCl3	1,1,1-trifluoro-2,2,2-trichloroethane	cf3ccl3
1500	C2F6	hexafluoroethane	c2f6
1501	C2Cl6	hexachloroethane	c2cl6
1502	IF7	Iodine heptafluoride	if7
1503	C6H4F2	metadifluorobenzene	mdfb
1504	C6H4F2	orthodifluorobenzene	odfb
1505	C6H4Cl2	1,2-dichlorobenzene	dcb12
1506	C6H4Cl2	1,3-dichlorobenzene	dcb13
1507	C9H8	Indene	indene
1508	C9H8	spiro[4.4]nona-1,3,6,8-tetraene	snt
1509	C9H12	n-propyl benzene	prbz
1510	C9H20	Nonane	nonane
1511	C(CN)4	tetracyanomethane	c5n4
1512	C5H4N4	purine	purine
1513	C8H7N	Indole	indole
1514	C3H3N3O3	cyanuric acid	cyanuric
1515	C6H5NO2	Nitrobenzene	c6h5no2
1516	C6H5COOH	benzoic acid	benzo
1517	CH3COC6H5	acetophenone	acph
1518	C3Cl3N3	1,3,5-Triazine, 2,4,6-trichloro-	c3cl3n3
1519	C6H3F3	Benzene trifluoride 123	bzf3a
1520	C10H8	Azulene	azu
1521	C10H8	naphthalene	naph
1522	C10H16	adamantane	adamantane
1523	C6N4	Tetracyanoethylene	tcne
1524	C6N4-	tetracyanoethylene anion	tcne-
1525	C10H22	Decane	decane
1526	C4F6	perfluorobutadiene	c4f6
1527	SF5CF3	Sulfur, pentafluoro(trifluoromethyl)-	sf5cf3
1528	C3F8	perfluoropropane	c3f8
1529	Fe(CO)5	Iron pentacarbonyl	ipc
1530	Fe(C5H5)2	ferrocene	fecp2
1531	B12H12--	Dodecahydrododecaborate(2-)	b12h12--
1532	C12H8	Acenaphthylene	acenaph
1533	C12H8	biphenylene	biph
1534	C12H10	biphenyl	biphenyl
1535	C12H10	Heptalene	heptalene
1536	C6H12O6	Inositol	inositol
1537	C6F6	hexafluorobenzene	c6f6
1538	S2F10	disulphur decafluoride	s2f10
1539	C14H10	Anthracene	anth
1540	C14H10	Phenanthrene	phenanthrene
1541	C12H10N2	azobenzene	azobenzene
1542	C6H5COC6H5	benzophenone	benzophenone
1543	C16H10	Pyrene	pyrene
1544	C18H12	Tetracene	tetracene
1545	C19H16	Triphenylmethane	tpm
1546	C24H12	Coronene	coronene
1547	C60	Buckminsterfullerene	c60