National Institute of Standards and Technology

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

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

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

List of which calculations are completed at B2PLYP /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	K	Potassium atom	2S	Kh
10	LiH	Lithium Hydride	1Σ	C∞v
11	KH	Potassium hydride	1Σ	C∞v
12	Be	Beryllium atom	1S	Kh
13	Mg	Magnesium atom	1S	Kh
14	MgH	magnesium monohydride	2Σ	C∞v
15	ZnH+	Zinc, protonated
16	BeH2+	Beryllium dihydride cation
17	B	Boron atom	2P	Kh
18	Al	Aluminum atom	2P	Kh
19	Al-	Aluminum atom anion	3P	Kh
20	Al+	Aluminum atom cation	1S	Kh
21	Ga	Gallium atom	2P
22	Ga-	Gallium atom anion	3P	Oh
23	Ga+	Gallium atom cation	1S
24	GaH	Gallium monohydride	1Σ	C∞v
25	GaH+	Gallium monohydride cation	2Σ	C∞v
26	BH3+	boron trihydride cation	2B2	C2v
27	BH3+	boron trihydride cation		C2v
28	AlH3-	aluminum trihydride anion		C3v
29	BH4-	borohydride anion	1A1	Td
30	C	Carbon atom	3P0	Kh
31	Si	Silicon atom	3P	Kh
32	Si	Silicon atom	1S	Kh
33	Si-	Silicon atom anion	4S	Kh
34	Ge	Germanium atom	3P	Kh
35	Ge-	Germanium anion	4S	Kh
36	Ge+	Germanium cation	2P	Kh
37	CH	Methylidyne	2Π1/2	C∞v
38	SiH	Silylidyne	2Π	C∞v
39	GeH	germylidene	2Π	C∞v
40	CH2-	methylene anion	2B1	C2v
41	GeH2	germylene	1A1	C2v
42	CH3	Methyl radical	2A1	D3h
43	SiH3	Silyl radical	2A1	C3v
44	SiH3+	Silyl cation	1A1'	D3h
45	GeH3	Germyl radical	2A1	C3v
46	GeH3+	germyl cation	1A1'	D3h
47	CH4	Methane	1A1	Td
48	SiH2D2	silane-d2
49	SiH4	Silane	1A1	Td
50	GeH4	Germane	1A1	Td
51	SiH5+	Silane, protonated
52	N	Nitrogen atom	4S	Kh
53	P	Phosphorus atom	4S	Kh
54	V+	Vanadium atom cation	5D	Kh
55	As	Arsenic atomic	4S	Kh
56	As-	Arsenic anion	3P	Kh
57	As+	Arsenic cation	3P	Kh
58	PH	phosphorus monohydride	3Σ-	C∞v
59	AsH	Arsenic monohydride	3Σ	C∞v
60	NH2	Amino radical	2B1	C2v
61	NH2+	Amino cation	3B1	C2v
62	NH2+	Amino cation	1A1	C2v
63	NH3	Ammonia	1A1	C3v
64	PH3	Phosphine	1A1	C3v
65	PH3+	Phosphine cation	2A1	C3v
66	AsH3	Arsine	1A1	C3v
67	AsH3+	Arsine cation	2A1	C3v
68	AsH4+	Arsonium
69	NH4	Ammonium radical
70	PH4	Phosphoranyl radical
71	O	Oxygen atom	3S	Kh
72	S	Sulfur atom	3P	Kh
73	S	Sulfur atom
74	Se	Selenium atom	3P	Kh
75	Se-	Selenium atom anion	2P	Kh
76	Se+	Selenium atom cation	4S	Kh
77	OH	Hydroxyl radical	2Π	C∞v
78	OH+	hydoxyl cation	3Σ	C∞v
79	HS-	mercapto anion	1Σ	C∞v
80	HS+	sulfur monohydride cation	3Σ	C∞v
81	CrH	Chromium hydride	6Σ	C∞v
82	CrH+	Chromium hydride cation	5Σ	C∞v
83	HSe	Selenium monohydride	2Π	C∞v
84	HSe-	selenium monohydride anion	1Σ	C∞v
85	HSe+	selenium monohydride cation	3Σ	C∞v
86	H2O	Water	1A1	C2v
87	H2O-	water anion	2A1	C2v
88	H2O-	water anion	2A'	Cs
89	H2O+	water cation	2B1	C2v
90	HDO	Water-d1	1A1	C2v
91	H2S+	Hydrogen sulfide cation	2B1	C2v
92	H2Se	Hydrogen selenide	1A1	C2v
93	H2Se+	Hydrogen selenide cation	2B1	C2v
94	H3S+	Sulfonium cation	1A1	C3v
95	H3Se+	Hydrogen Selenide, protonated	1A1	C3v
96	F	Fluorine atom	2P	Kh
97	Cl	Chlorine atom	2P	Kh
98	Br	Bromine atom	2P	Kh
99	Br-	Bromine atom anion	1S	Kh
100	Br+	Bromine atom cation	3P	Kh
101	HF	Hydrogen fluoride	1Σ	C∞v
102	HF-	hydrogen fluoride anion	2Σ	C∞v
103	HF+	hydrogen fluoride cation	2Π	C∞v
104	HCl	Hydrogen chloride	1Σ	C∞v
105	HCl-	hydrogen chloride anion	2Σ	C∞v
106	HCl+	hydrogen chloride cation	2Π	C∞v
107	HBr	hydrogen bromide	1Σ	C∞v
108	HBr-	hydrogen bromide anion	2Σ	C∞v
109	HBr+	hydrogen bromide cation	2Π	C∞v
110	H2Cl+	dihydrogen monochloride cation	1A1	C2v
111	H2Br+	protonated hydrogen bromide	2A1	C2v
112	Ne	Neon atom	1S	Kh
113	Ne	Neon atom
114	Kr	Krypton atom	1S	Kh
115	Kr+	Krypton cation	2P	Kh
116	HeLi+	Helium Lithium cation
117	ArH+	Argon hydride cation	1Σ	C∞v
118	KrH+	Protonated Krypton	1Σ	C∞v
119	NaLi	lithium sodium	1Σ	C∞v
120	Na2	Sodium diatomic	1Σg	D∞h
121	Na2-	sodium diatomic anion	2Σu	D∞h
122	LiAl	Lithium Aluminum
123	HBBH	Diborane(2)	3ΣG	D∞h
124	B2H4	Diborane(4) D2d	1A1	D2d
125	B2H6	Diborane	1Ag	D2h
126	B2H6+	Diborane cation
127	CaC	Calcium monocarbide
128	BSi	Boron silicide	4Σ	C∞v
129	BSi	Boron silicide	2Σ	C∞v
130	GeC	Germanium monocarbide	1Σ	C∞v
131	SiGe	Silicon Germanium
132	C2H-	Ethynyl anion	1Σ	C∞v
133	C2H2	Acetylene	1Σg	D∞h
134	C2H2+	acetylene cation	2Πu	D∞h
135	C2H2+	acetylene cation
136	H2CC-	vinylidene anion
137	HCCH-	acetylene anion
138	HCCH-	acetylene anion
139	Si2H2	disilyne
140	Si2H2	disilyne
141	Si2H2	disilyne
142	Si2H2	disilyne
143	CH3Li	methyl lithium	1A1	C3v
144	C2H3	vinyl	2A'	Cs
145	C2H3+	vinyl cation	1A1	C2V bridging H
146	C2H3+	vinyl cation	1A1	C2V HCCH2
147	C2H4	Ethylene	1Ag	D2h
148	C2H4+	Ethylene cation	2B3	D2
149	Si2H4	Disilene
150	Si2H4	Disilene
151	Si2H4	Disilene
152	C2H5	Ethyl radical	2A'	Cs
153	C2H6	Ethane	1A1g	D3d
154	Si2H6	disilane	1Eu	D3d
155	LiN	Lithium Nitride	3Σ	C∞v
156	LiP	Lithium monophosphide
157	LiP	Lithium monophosphide
158	MgN	Magnesium Nitride
159	MgN	Magnesium Nitride
160	GaAs	Gallium arsenide	3Π
161	GaAs	Gallium arsenide	1Σ
162	CN	Cyano radical	2Σ	C∞v
163	SiP	Silicon monophosphide	2Π	C∞v
164	N2	Nitrogen diatomic	1Σg	D∞h
165	N2	Nitrogen diatomic
166	PN	Phosphorus mononitride	1Σ	C∞v
167	HCN	Hydrogen cyanide	1Σ	C∞v
168	HCN+	hydrogen cyanide cation	2Π	C∞v
169	HNC+	hydrogen isocyanide cation
170	HCP+	Phosphaethyne cation
171	NNH+	Dinitrogen monohydride cation	1Σ	C∞v
172	LiNH2	lithium amide
173	HBNH	Boranimine	1Σ	C∞v
174	H2NN	Isodiazene
175	N2H2+	trans-diazene cation	2AG	C2h
176	CH2NH	Methanimine	1A'	Cs
177	CH2NH+	Methanimine cation
178	CHNH2	aminomethylene
179	CHNH2+	Aminocarbene cation
180	BH2NH2	Boranamine
181	N2H4	Hydrazine	1A	C2
182	CH3NH2	methyl amine	1A'	Cs
183	SiH3NH2	Silane, amino
184	BH3PH3	borane phosphine
185	BH3NH3	borane ammonia	1A1	C3v
186	CH3NH3	methyl ammonium radical	2A1	C3v
187	N2H7+	ammonia ammonium dimer
188	LiSe	Lithium monoselenide
189	CaO	Calcium monoxide	1Σ	C∞v
190	CaS	Calcium sulfide	1Σ	C∞v
191	BO	boron monoxide	2Σ	C∞v
192	GaS	Gallium monosulfide
193	CO	Carbon monoxide	1Σ	C∞v
194	CO-	carbon monoxide anion	2Π	C∞v
195	CO+	carbon monoxide cation	2Σ	C∞v
196	SiO	Silicon monoxide	1Σ	C∞v
197	SiS	silicon monosulfide	1Σ	C∞v
198	CSe	Carbon monoselenide	1Σ	C∞v
199	GeO	Germanium monoxide	1Σ	C∞v
200	SiSe	Silicon Monoselenide
201	SiSe+	Silicon Monoselenide cation
202	GeSe	Germanium monoselenide
203	NO	Nitric oxide	2Π	C∞v
204	NO-	nitric oxide anion	3Σ	C∞v
205	NO+	nitric oxide cation	1Σ	C∞v
206	PO	Phosphorus monoxide	2Π	C∞v
207	PS	phosphorus sulfide	2Σ	C∞v
208	NSe	Nitrogen monoselenide	2Π	C∞v
209	AsS	Arsenic monosulfide	2Π	C∞v
210	PSe	Phosphorus monoselenide	2Π	C∞v
211	AsSe	Arsenic monoselenide	2Π	C∞v
212	O2	Oxygen diatomic	3Σg	D∞h
213	O2--	dioxygen dianion
214	SO	Sulfur monoxide	3Σ	C∞v
215	SO	Sulfur monoxide	1Σ	C∞v
216	SO+	sulfur monoxide cation	2Π	C∞v
217	S2	Sulfur diatomic	3Σg	D∞h
218	SeO	Selenium monoxide	3Σ	C∞v
219	Se2	Selenium diatomic	3Σg	D∞h
220	LiOH	lithium hydroxide	1Σ	C∞v
221	KOH	Potassium hydroxide	1Σ	C∞v
222	BeOH	beryllium monohydroxide	2A'	Cs
223	HBO	Boron hydride oxide	1Σ	C∞v
224	HBS	hydrogen boron sulfide	1Σ	C∞v
225	COH	Hydroxymethylidyne
226	HCO	Formyl radical	2A'	Cs
227	HCO-	formyl anion	1A'	Cs
228	HCO+	Formyl cation	1Σ	C∞v
229	HNO	Nitrosyl hydride	1A'	Cs
230	HNO+	Nitrosyl hydride cation	2A'	Cs
231	HSO+	Sulfur Monoxide, S-protonated
232	SOH	Sulfur Hydroxide
233	SOH+	Sulfur Monoxide, protonated
234	H2CO	Formaldehyde	1A1	C2v
235	H2CO-	formaldehyde anion	2A'	Cs
236	H2CO-	formaldehyde anion
237	H2CO+	formaldehyde cation	2B2	C2v
238	H2CS	Thioformaldehyde	1A1	C2v
239	H2CS-	thioformaldehyde anion
240	H2CS-	thioformaldehyde anion
241	H2CSe	Selenoformaldehyde
242	H2O2	Hydrogen peroxide	1A	C2
243	H2O2	Hydrogen peroxide	1Ag	C2h
244	H2OO	water oxide
245	HOSH	hydrogen thioperoxide
246	H2Se2	hydrogen diselenide
247	CH2OH+	hydroxymethyl cation	1A'	Cs
248	CH3O-	methoxy anion	1A1	C3v
249	NH2OH	hydroxylamine	1A'	Cs
250	NH2OH+	Hydroxylamine cation
251	NH2SH	Thiohydroxylamine
252	NH2SH	Thiohydroxylamine
253	NH3S	sulfidoazane
254	CH3OH	Methyl alcohol	1A'	Cs
255	CH3OH+	Methyl alcohol cation	2A"	Cs
256	CH3SH	Methanethiol	1A'	Cs
257	SiH3OH	silanol
258	NH2OH2+	protonated hydroxylamine
259	NH3OH+	N-protonated hydroxylamine
260	H5O2+	Dihydroxonium ion	1A	C2
261	LiF	lithium fluoride	1Σ	C∞v
262	LiCl	lithium chloride	1Σ	C∞v
263	NaF+	sodium fluoride cation	2Σ	C∞v
264	LiBr	Lithium Bromide	1Σ	C∞v
265	LiF+	lithium fluoride cation	2Π	C∞v
266	CaBr	Calcium monobromide
267	BF	Boron monofluoride	1Σ	C∞v
268	AlF	Aluminum monofluoride	1Σ+	C∞v
269	GaF	Gallium monofluoride	1Σ	C∞v
270	AlBr	Aluminum monobromide
271	GaCl	Gallium monochloride	1ΣG	C∞v
272	GaBr	Gallium monobromide
273	CF	Fluoromethylidyne	2Π	C∞v
274	SiCl	Clorosilylidyne	2Π	C∞v
275	CBr	Carbon monobromide	2Π	C∞v
276	GeF	Germanium monofluoride	2Π	C∞v
277	GeCl	Germanium monochloride	2Π	C∞v
278	GeCl+	Germanium monochloride cation
279	SiBr	Silicon monobromide	2Π	C∞v
280	SiBr+	Silicon monobromide cation
281	NCl	nitrogen monochloride	3Σ	C∞v
282	PBr	Phosphorus monobromide
283	ClO	Monochlorine monoxide	2Π	C∞v
284	ClO+	chlorine monoxide cation	3Σ	C∞v
285	SF	Monosulfur monofluoride	2Π	C∞v
286	SF+	sulfur monofluoride cation	3Σ	C∞v
287	SCl+	sulfur monochloride cation	3Σg	C∞v
288	BrO	Bromine monoxide	2Π	C∞v
289	BrO+	Bromine monoxide cation
290	SBr	Sulfur monobromide radical
291	SBr+	Sulfur monobromide cation
292	SeBr	Selenium monobromide
293	BrCl	Bromine monochloride	1Σ	C∞v
294	F2	Fluorine diatomic	1Σg	D∞h
295	F2+	flourine diatomic cation	2Πg	D∞h
296	ClF	Chlorine monofluoride	1Σ+	C∞v
297	ClF+	clorine monofluoride cation	2Π	C∞v
298	Cl2	Chlorine diatomic	1Σg	D∞h
299	Cl2+	chlorine diatomic cation	2Πg	D∞h
300	BrF	Bromine monofluoride	1Σ	C∞v
301	Br2	Bromine diatomic	1Σg	D∞h
302	Br2-	bromine diatomic anion	2Σu	D∞h
303	Br2+	bromine diatomic cation	2Πg	D∞h
304	HCF	Fluoromethylene	1A'	Cs
305	HCF	Fluoromethylene	3A"	Cs
306	HSiF	fluorosilylene
307	HSiCl	Chlorosilylene
308	HSiBr	monobromosilylene
309	HOF	Hypofluorous acid	1A'	Cs
310	HOCl	hypochlorous acid	1A'	Cs
311	HOCl+	hypochlorous acid cation
312	F2H+	Fluorine, protonated	1A'	Cs
313	ClFH+	Chlorine fluoride, F-protonated
314	FClH+	Chlorine fluoride, Cl-protonated
315	Cl2H+	Chlorine, protonated	1A'	Cs
316	CH2Br	bromomethyl radical
317	CH2F	fluoromethyl radical	2A	Cs
318	CH2F+	fluoromethyl cation
319	CH2Cl+	chloromethyl cation
320	CH2Cl	chloromethyl radical	2A'	Cs
321	CH2Cl	chloromethyl radical	2B1	C2v
322	NH2Cl	chloramine	1A'	Cs
323	CH3F+	methyl fluoride cation
324	CH3F	Methyl fluoride	1A1	C3v
325	CH3Cl	Methyl chloride	1A1	C3v
326	CH3Cl+	Methyl chloride cation
327	SiH3F	monofluorosilane	1A1	C3v
328	SiH3Cl	chlorosilane	1A1	C1
329	CH3Br	methyl bromide	1A1	C3v
330	GeH3F	monofluorogermane
331	GeH3Cl	monochlorogermane
332	NH3Cl+	protonated monochloroammonia
333	CH3ClH+	methyl chloride, protonated
334	NH4Cl	Ammonium chloride
335	LiNe+	Lithium Neon cation
336	Ar2	Argon diatomic	1Sg	D∞h
337	C3	carbon trimer	1Σg	D∞h
338	C3	carbon trimer	1A1	C2v
339	SiC2	Silicon dicarbide
340	C3H4	cyclopropene	1A1	C2v
341	CH2CCH2	allene	1A1	D2d
342	CH3CCH	propyne	1A'	C3v
343	C3H5	Allyl radical	2A2	C2v
344	C3H6	Cyclopropane	1A1'	D3h
345	CH2CHCH3	Propene	1A'	Cs
346	C3H7	n-Propyl radical	2A"	C1
347	CH3CHCH3	Isopropyl radical	2A	C2
348	CH3CHCH3+	Isopropyl cation	1A	C2
349	C3H8	Propane	1A1	C2v
350	Si3H8	trisilane
351	LiCN	lithium cyanide	1Σ	C*V LiCN
352	KCN	Potassium cyanide	1Σ	C∞v
353	KCN	Potassium cyanide	1Σ	C∞v
354	KCN	Potassium cyanide	1A'	Cs
355	ZnCN	Zinc monocyanide	2Σ	C∞v
356	ZnNC	Zinc isocyanide	2Σ	C∞v
357	AlCN	Aluminum monocyanide
358	AlNC	Aluminum isocyanide
359	CNN	Diazocarbene
360	N3	azide radical	2Πg	D∞h
361	HN3	hydrogen azide	1A'	Cs
362	HN3+	Hydrazoic acid cation
363	HNCNH	diiminomethane	1A	C2
364	HNNNH+	1,2-Triazadienium
365	NH2NN+	hydrazoic acid, protonated
366	CH3CN	Acetonitrile	1A1	C3v
367	CH3CN-	acetonitrile anion	2E	C3v
368	CH3CN-	acetonitrile anion	2A'	Cs
369	CHNCH2	2H-Azirine
370	CHNHCH	1H-Azirine
371	H2CCNH	Ethenimine
372	H2CNCH	methyleneaminomethylene
373	HCCNH2	Ethynamine
374	HCNCH2+	2H-Azirine cation
375	NH2CNH+	cyanamide, cn protonated
376	NH3CN+	cyanamide, amine protonated
377	C2H6N+	aziridine, protonated	1A1	C2v
378	CH3CH2NH2	Ethylamine
379	Li2O	dilithium oxide	1Σg	D∞h
380	Na2O	disodium monoxide	1Σg	Linear
381	Na2O	disodium monoxide	1A1	C2v
382	Na2S	Sodium sulfide
383	Na2S	Sodium sulfide
384	LiO2	Lithium dioxide
385	NaO2	Sodium superoxide
386	NCO	isocyanato radical	2Π	C∞v
387	N2O	Nitrous oxide	1Σ	C∞v
388	CO2	Carbon dioxide	1Σg	D∞h
389	OCS	Carbonyl sulfide	1Σ	C∞v
390	CS2	Carbon disulfide	1Σg	D∞h
391	GeO2	Germanium dioxide	1Σg	D∞h
392	OCSe	Carbonyl selenide	1Σ	C∞v
393	SCSe	Carbon sulfide selenide
394	NO2	Nitrogen dioxide	2A1	C2v
395	NSO	sulfinyl amidogen
396	SNO	Nitrogen oxide sulfide
397	SO2	Sulfur dioxide	1A1	C2v
398	SSO	Disulfur monoxide	1A'	Cs
399	S3	Sulfur trimer	1A1	C2v
400	S3	Sulfur trimer
401	SeO2	Selenium dioxide	1A1	C2v
402	HCCO	ketenyl radical	2Π	C∞v
403	HCCO	ketenyl radical	2A"	Cs
404	HCNO	fulminic acid	1Σ	C∞v
405	HNCS	Isothiocyanic acid
406	HSCN	thiocyanic acid	1A'	Cs
407	HOCO	Hydrocarboxyl radical	1A'	cis
408	HOCO	Hydrocarboxyl radical	1A'	trans
409	O3H+	protonated ozone	1A'	Cs
410	O3H+	protonated ozone
411	C2H2O	Oxirene	1A1	C2v
412	CH2CO	Ketene	1A1	C2v
413	CH2CS	Thioketene
414	Be(OH)2	Beryllium hydroxide
415	Be(OH)2	Beryllium hydroxide
416	H2COO	Dioxymethyl radical	2A'	Cs
417	H2COO+	dioxymethyl cation	2A'	Cs
418	HCOOH	Formic acid	1A'	Cs
419	HCOOH	Formic acid
420	BH3CO	Borane carbonyl	1A1	C3v
421	CH2COH+	ketene, protonated
422	HOCHNH	hydroxymethylimine	1A'	CS H all up
423	CHSNH2	thioformamide
424	NHCHSH	Methanimidothioic acid
425	C2H4O	Ethylene oxide	1A1	C2v
426	C2H4O+	ethylene oxide cation
427	CH3CHO	Acetaldehyde	1A'	Cs
428	CH3CHO+	acetaldehyde cation
429	H2COCH2+	Methyl, (methyleneoxoniumyl)-
430	C2H4S	Thiirane	1A1	C2v
431	CH2CHSH	Ethenethiol
432	CH3CHS	Thioacetaldehyde	1A'	C1
433	NH2CHOH+	Formamide, O-protonated
434	CH3SSH	Hydrogen methyl disulfide
435	HSCH2SH	Methanedithiol
436	C2H4OH+	ethylene oxide, protonated	1A'	Cs
437	NH2CH2OH	aminomethanol
438	CH3CH2OH	Ethanol	1A'	Cs
439	CH3OCH3	Dimethyl ether	1A1	C2v
440	CH3CH2SH	ethanethiol	1A'	Cs
441	CH3CH2SH	ethanethiol	1A	C1
442	CH3SCH3	Dimethyl sulfide	1A1	C2v
443	CH3SCH3+	dimethyl sulfide cation
444	CNF	iso cyanogen fluoride	1Σ	C∞v
445	BrCN	Cyanogen bromide	1Σ	C∞v
446	FBO	Boron monofluoride monoxide
447	BeBr2	Beryllium bromide
448	CaBr2	Calcium dibromide
449	BF2	Boron difluoride radical	2A1	C2v
450	FNO	Nitrosyl fluoride	1A'	Cs
451	ClNO	Nitrosyl chloride	1A'	Cs
452	FSN	Thiazyl fluoride	1A'	Cs
453	OPCl	Phosphorus oxychloride
454	CF2	Difluoromethylene	1A1	D∞h
455	CFCl	chlorofluoromethylene	1A'	Cs
456	SiF2	Silicon difluoride	1A1	C2v
457	GeCl2	Germanium dichloride	1A1	C2v
458	CBr2	dibromomethylene	1A1	C2v
459	CBr2	dibromomethylene	3B1	C2v
460	FOO+	Fluorine dioxide cation
461	OClO	Chlorine dioxide	2B1	D∞h
462	OClO-	Chlorine dioxide anion	1A'	Cs
463	BrOO	Bromine dioxide
464	OBrO	Bromine dioxide radical	2B1	C2v
465	PF2	Phosphorus difluoride
466	PF2+	Phosphorus difluoride cation
467	FClO	chlorosyl fluoride	1A'	Cs
468	ClOF	Chlorine hypofluorite	1A'	Cs
469	SF2	sulfur difluoride	1A1	C2v
470	SeF2	Selenium difluoride
471	SeCl2	Selenium Dichloride
472	SBr2	Sulfur dibromide
473	SeBr2	Selenium dibromide
474	Br3-	tribromide anion
475	SFCl	Sulfur chloride fluoride
476	HCCF	Fluoroacetylene	1Σ	C∞v
477	HCCBr	bromoacetylene	1Σ	C∞v
478	CHF2	difluoromethyl radical	2A	Cs
479	CHF2+	difluoromethyl cation
480	CHFCl	Chlorofluoromethyl radical
481	CHFCl+	Chlorofluoromethyl cation
482	CHCl2+	dichloromethyl cation
483	CHBr2	dibromomethyl radical
484	NHF2	difluoramine
485	NHCl2	dichloroamine
486	CH2F2	Methane, difluoro-	1A1	C2v
487	SiH2F2	difluorosilane
488	CH2Cl2	Methylene chloride	1A1	C2v
489	CH2BrCl	Methane, bromochloro-	1A'	Cs
490	CH2Br2	dibromomethane	1A1	C2v
491	CH3MgBr	Methyl Magnesium Bromide
492	CH2CHF	Ethene, fluoro-	1A'	Cs
493	CH2FOH	fluoromethanol
494	CH2CH2Cl	2-chloroethyl radical	2A'	Cs
495	CHClCH3	1-chloroethyl radical	2A	C1
496	C2H5Br	Ethyl bromide	1A'	Cs
497	C4	Carbon tetramer	3Σg	D∞h
498	C4	Carbon tetramer
499	C4H2+	diacetlyene cation	2Πg	D∞h
500	C4H4	Tetrahedrane
501	C4H6	1-Methylcyclopropene	1A	C1
502	CH2CHCH2CH3	1-Butene	1A	C1
503	CH3CH2CH2CH3	Butane	1Ag	Anti
504	As4	Arsenic tetramer	1A1	Td
505	HCCCN+	Cyanoacetylene cation	2Π	C∞v
506	H2CNCN	cyanamide, methylene
507	HNCCNH	Ethenediimine
508	C2H5CN	ethyl cyanide	1A'	Cs
509	H2NCHCHNH2	diaminoethylene
510	CH7N3	triaminomethane
511	NH2CH2CH2CH3	1-Propanamine	1A'	Cs
512	N(SiH3)3	trisilylamine
513	K2O2	dipotassium dioxide
514	ONNO	NO dimer	1Ag	trans C2H
515	ONNO	NO dimer	1A1	cis C2V
516	S2N2	Disulfur dinitride	1AG	D2h
517	CS3--	Carbonotrithioate
518	SO3	Sulfur trioxide	1A1'	D3h
519	SO3--	Sulfate dianion
520	S4	Sulfur tetramer
521	S4	Sulfur tetramer
522	S4	Sulfur tetramer
523	HNO3	Nitric acid	1A'	Cs
524	C3H2O	Propadienal
525	C3H2O	Propadienal
526	C2H2O2	Ethanedial	1Ag	C2h
527	C2H3NO	Nitrosoethylene
528	CH3NCO	methylisocyante
529	HOCH2CN	cyanomethanol
530	CH3NO2	Methane, nitro-	1A'	Cs
531	H3AlO3	Aluminum hydroxide
532	CH2CHCHO	Acrolein	1A'	Cs
533	CH2CHCHO	Acrolein
534	CH2C(OH)NH2	1-amino vinyl alchohol
535	CH3C(OH)=NH	Ethaninidic acid
536	CH3CSNH2	Ethanethioamide
537	C3H6O	Acetone enol	1A'	Cs
538	CH3CH2CHO	Propanal	1A'	Cs
539	CH3COCH3	Acetone	1A1	C2v
540	CH3SOCH3	Dimethyl sulfoxide	1A'	Cs
541	C3H7OH	1-Propanol
542	Li2F2	Lithium fluoride dimer
543	CF2O	Carbonic difluoride	1A1	C2v
544	CF2O+	Carbonic difluoride cation
545	BF3+	boron trifluoride cation
546	BClF2	Chlorodifluoroborane
547	BCl3	Borane, trichloro-	1A1'	D3h
548	BCl3+	Boron Trichloride cation
549	GaF3	Gallium trifluoride	1A1'	D3h
550	GaCl3	Gallium trichloride	1A1'	D3h
551	CF2Cl	difluorochloromethyl radical
552	CFCl2	dichlorofluoromethyl radical
553	CBr3	tribromomethyl radical
554	ClO2F	Chloryl fluoride	1A'	Cs
555	SSCl2	Thiothionyl chloride
556	NF3	Nitrogen trifluoride	1A1	C3v
557	NCl3	nitrogen trichloride	1A1	C3v
558	NBr3	Nitrogen Tribromide	1A1	C3v
559	HClO3	Chloric Acid	1A'	Cs
560	HClO3	Chloric Acid	1A	C1
561	CHF3	Methane, trifluoro-	1A1	C3v
562	SiHF3	trifluorosilane
563	CHBrF2	Methane, bromodifluoro-	1A'	Cs
564	CHFClBr	fluorochlorobromomethane	1A	C1
565	CHBrCl2	Methane, bromodichloro-	1A'	Cs
566	CHBr2F	dibromofluoromethane
567	AsF3H+	Arsenic trifluoride, protonated
568	C2H2ClF	1-chloro-1-fluoroethylene	1A'	Cs
569	CHFCHCl	(E)-1-chloro-2-fluoroethene	1A'	Cs
570	CHFCHClz	(Z)-1-Chloro-2-fluoroethene	1A'	Cs
571	CHBrCHBr	Ethene, 1,2-dibromo-, (E)-
572	CHBrCHBr	Ethene, 1,2-dibromo-, (Z)-
573	C2H4F2	1,2-difluoroethane	1Ag	C2H anti
574	C2H4F2	1,2-difluoroethane	1A	C2 gauche
575	CH3CHF2	Ethane, 1,1-difluoro-	1A'	Cs
576	CH2BrCH2Cl	1-bromo-2-chloroethane
577	CH2BrCH2Br	Ethane, 1,2-dibromo-	1Ag	C2h
578	CH2BrCH2Br	Ethane, 1,2-dibromo-	1A	C2
579	CH2CHCH2F	Allyl Fluoride
580	CH2CHCH2F	Allyl Fluoride
581	CH3CHCHF	trans-1-Fluoro-1-propene
582	CH2FCH2OH	2-fluoroethanol
583	CH2FCH2CH3	1-Fluoropropane	1A'	Cs
584	CH2FCH2CH3	1-Fluoropropane
585	CH3CHFCH3	2-Fluoropropane	1A'	Cs
586	CH3CHClCH3	Propane, 2-chloro-	1A'	Cs
587	B5H9	pentaborane9
588	C5H4	pentatetraene
589	C5H6	Propellane	1A1	D3h
590	C5H8	Bicyclo[1.1.1]pentane
591	C3H4N2	2H-Imidazole	1A1	C2v
592	C4H5N	Pyrrole	1A1	C2v
593	C3O2	Carbon suboxide	1ΣG	D∞h
594	B2O3	diboron trioxide
595	B2O3	diboron trioxide
596	CHOOCHO	diformyl ether
597	C3H3NO	Isoxazole	1A'	Cs
598	C3H3NS	Thiazole
599	C4H4O	Furan	1A1	C2
600	CH3COCCH	3-butyn-2-one	1A'	Cs
601	C4H4Se	selenophene
602	HCOOC2H5	Ethyl formate	1A'	Cs
603	C2H6O2S	Dimethyl sulfone	1A1	C2v
604	C4H8S	Thiophene, tetrahydro-	1A	C1
605	C4H10O	Ethoxy ethane	1A1	C2v
606	C4H10O	Methyl propyl ether	1A	C1
607	C(CH3)3SH	2-Propanethiol, 2-methyl-	1A'	Cs
608	C4H9SH	1-Butanethiol
609	CF3Cl	Methane, chlorotrifluoro-	1A1	C3v
610	CF2Cl2	difluorodichloromethane	1A1	C2v
611	CF3Br	Bromotrifluoromethane	1A1	C3v
612	GeF4	Germanium tetrafluoride	1A1	Td
613	CCl4	Carbon tetrachloride	1A1	Td
614	CBrCl2F	bromodichlorofluoromethane
615	CBr2ClF	dibromochlorofluoromethane
616	CBr2Cl2	dibromodichloromethane	1A1	C2v
617	CBr3Cl	tribromochloromethane	1A1	C3v
618	CBr4	Carbon tetrabromide	1A1	Td
619	GeBr4	Germanium tetrabromide
620	SF4	Sulfur tetrafluoride	1A1	C2v
621	SeF4	Selenium tetrafluoride
622	SCl4	Sulfur tetrachloride
623	CH2ClCCCl	1,3-dichloropropyne
624	CHCl2CCH	3,3-dichloropropyne
625	CHCl2CHO	dichloroacetaldehyde
626	CHF2CH2F	Ethane, 1,1,2-trifluoro	1A	C1
627	CHF2CH2F	Ethane, 1,1,2-trifluoro	1A'	Cs
628	CH2CClCHCH2	1,3-Butadiene, 2-chloro-
629	CH2FCH2CH2F	1,3-difluoropropane
630	CH3CCl2CH3	Propane, 2,2-dichloro-	1A1	C2v
631	C2H2N2O	Furazan
632	C6H6	Prismane
633	C6H6	1,2,4,5-Hexatetraene	1Ag	C2h
634	C6H6	Benzene	1A1g	D6h
635	C6H6	Benzvalene	1A1	C2v
636	C6H6	Dewar Benzene
637	N3P3	1,3,5,2,4,6-Triazatriphosphorine
638	C3H2O3	vinylene carbonate
639	C5H6O	2H-Pyran
640	C5H6O	Pentadienal
641	C4H6O2	γ–Butyrolactone	1A	C1
642	C3H6O3	1,3,5-Trioxane	1A1	C1
643	C4H8O2	Ethyl acetate	1A'	Cs
644	C5H10O	3-Pentanone	1A1	C2v
645	C4F2	difluorobutadiyne
646	C2ClF3	Ethene, chlorotrifluoro-
647	C2Br4	tetrabromoethene
648	SiF5-	silicon pentafluoride anion
649	PF5	Phosphorus pentafluoride	1A1'	D3h
650	CHCl2CHCl2	Ethane, 1,1,2,2-tetrachloro-
651	CH2BrCBr3	1,1,1,2-tetrabromo ethane
652	C7H7	cycloheptatrienyl radical	2A2	C2v
653	C7H7+	cycloheptatrienyl cation	1A1'	D7h
654	CH(CN)3	tricyanomethane
655	HN=C=C(CN)2	Dicyanoketenimine
656	C5H4O2	furfural	1A'	OCCO cis
657	C5H4O2	furfural	1A'	OCCO trans
658	C6H12O	Oxepane
659	F2CCCF2	tetrafluoroallene
660	SF6	Sulfur Hexafluoride	1A1G	Oh
661	C8H8	cubane	1A1G	Oh
662	S4N4	Tetrasulfur tetranitride
663	C6H5CHO	benzaldehyde	1A'	Cs
664	C6H4F2	1,4-difluorobenzene	1Ag	D2h
665	C6H4Cl2	1,4-dichlorobenzene
666	C6H5NO	nitrosobenzene	1A'	Cs
667	C3F6	hexafluoropropene
668	C8H18O	1-Octanol
669	C10H10	bullvalene
670	B12H12--	Dodecahydrododecaborate(2-)
671	C13H10	Fluorene
672	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	Li+	Lithium atom cation	li+
15	Na	Sodium atom	na
16	Na-	Sodium atom anion	na-
17	Na+	Sodium atom cation	na+
18	K-	Potassium atom anion	k-
19	K+	Potassium atom cation	k+
20	Cu	Copper atom	cu
21	Cu-	Copper atom anion	cu-
22	Cu+	Copper atom cation	cu+
23	LiH-	lithium hydride anion	lih-
24	LiH+	lithium hydride cation	lih+
25	NaH	sodium hydride	nah
26	NaH-	sodium hydride anion	nah-
27	NaH+	sodium hydride cation	nah+
28	KH+	Potassium hydrogen cation	kh+
29	CuH	Copper monohydride	cuh
30	Be-	Beryllium atom anion	be-
31	Be+	Beryllium atom cation	be+
32	Mg-	Magnesium atom anion	mg-
33	Mg+	Magnesium atom cation	mg+
34	Ca	Calcium atom	ca
35	Ca-	Calcium atom anion	ca-
36	Ca+	Calcium atom cation	ca+
37	Zn	Zinc atom	zn
38	Zn-	Zinc atom anion	zn-
39	Zn+	Zinc atom cation	zn+
40	BeH	beryllium monohydride	beh
41	BeH-	berylium monohydride anion	beh-
42	BeH+	beryllium monohydride cation	beh+
43	MgH-	magnesium monohydride anion	mgh-
44	MgH+	magnesium monohydride cation	mgh+
45	CaH	Calcium monohydride	cah
46	CaH+	Calcium monohydride cation	cah+
47	TiH	Titanium monohydride	tih
48	ZnH	Zinc monohydride	znh
49	BeH2	beryllium dihydride	beh2
50	MgH2	magnesium dihydride	mgh2
51	CaH2	Calcium Hydride	cah2
52	ZnH2	Zinc hydride	znh2
53	B-	Boron atom anion	b-
54	B+	Boron atom cation	b+
55	Sc	Scandium atom	sc
56	Sc+	Scandium cation	sc+
57	BH	Boron monohydride	bh
58	BH-	boron monohydride anion	bh-
59	BH+	boron monohydride cation	bh+
60	AlH	aluminum monohydride	alh
61	AlH-	aluminum monohydride anion	alh-
62	AlH+	aluminum monohydride cation	alh+
63	ScH	Scandium monohydride	sch
64	ScH+	Scandium monohydride cation	sch+
65	BH2	boron dihydride	bh2
66	BH2-	boron dihydride anion	bh2-
67	BH2+	Boron dihydride cation	bh2+
68	AlH2	aluminum dihydride	alh2
69	AlH2-	aluminum dihydride anion	alh2-
70	AlH2+	aluminum dihydride cation	alh2+
71	BH3	boron trihydride	bh3
72	BH3-	boron trihydride anion	bh3-
73	AlH3	aluminum trihydride	alh3
74	AlH3+	aluminum trihydride cation	alh3+
75	ScH3	Scandium trihydride	sch3
76	GaH3	Gallium trihydride	gah3
77	BH4	borohydride	bh4
78	AlH4-	Aluminum tetrahydride anion	alh4-
79	C-	Carbon atom anion	c-
80	C+	Carbon atom cation	c+
81	Si+	Silicon atom cation	si+
82	Ti	Titanium atom	ti
83	Ti-	Titanium atom anion	ti-
84	Ti+	Titanium atom cation	ti+
85	Sn	Tin atom	sn
86	Sn+	Tin cation	sn+
87	CH-	methylidyne anion	ch-
88	CH+	Methylidyne cation	ch+
89	SiH-	silicon monohydride anion	sih-
90	SiH+	silicon monohydride cation	sih+
91	GeH+	Germaniun monohyrdide cation	geh+
92	CH2	Methylene	ch2
93	CH2+	methylene cation	ch2+
94	SiH2	silicon dihydride	sih2
95	SiH2-	silicon dihydride anion	sih2-
96	SiH2+	silicon dihydride cation	sih2+
97	GeH2-	germylene anion	geh2-
98	CH3-	methyl anion	ch3-
99	CH3+	methyl cation	ch3+
100	SiH3-	Silyl anion	sih3-
101	CD4	methane-d4	cd4
102	CH2D2	methane-d2	ch2d2
103	CH3D	methane-d	ch3d
104	CH4-	Methane anion	ch4-
105	CH4+	Methane cation	ch4+
106	CHD3	methane-d3	chd3
107	SiH4+	Silane cation	sih4+
108	SnH4	Stannane	snh4
109	N-	Nitrogen atom anion	n-
110	N+	Nitrogen atom cation	n+
111	P-	Phosphorus atom anion	p-
112	P+	Phosphorus atom cation	p+
113	V	Vanadium atom	v
114	Sb	Antimony atom	sb
115	NH	Imidogen	nh
116	NH-	Imidogen anion	nh-
117	NH+	imidogen cation	nh+
118	PH-	phosphorus monohydride anion	ph-
119	PH+	phosphorus monohydride cation	ph+
120	AsH+	Arsenic monohydride cation	ash+
121	SbH	Antimony monohydride	sbh
122	ND2	Amidogen-d2	nd2
123	NH2-	amino anion	nh2-
124	PH2	Phosphino radical	ph2
125	PH2-	Phosphino anion	ph2-
126	PH2+	Phosphino cation	ph2+
127	AsH2	Arsenic dihydride	ash2
128	AsH2+	Arsenic dihydride cation	ash2+
129	ND3	Ammonia-d3	nd3
130	NH3-	Ammonia anion	nh3-
131	NH3+	ammonia cation	nh3+
132	SbH3	Stibine	sbh3
133	NH4+	ammonium cation	nh4+
134	PH4+	phosphonium cation	ph4+
135	O-	Oxygen atom anion	o-
136	O+	Oxygen atom cation	o+
137	S-	Sulfur atom anion	s-
138	S+	Sulfur atom cation	s+
139	Cr	Chromium atom	cr
140	Te	Tellurium atom	te
141	Te+	Tellurium atom cation	te+
142	DO	Hydroxyl-d	od
143	OH-	hydroxide anion	oh-
144	DS	Mercapto-d	ds
145	HS	Mercapto radical	hs
146	TeH	Telluryl radical	teh
147	D2O	Deuterium oxide	d2o
148	D2S	Hydrogen sulfide-d2	d2s
149	H2S	Hydrogen sulfide	h2s
150	H2S-	Hydrogen sulfide anion	h2s-
151	H2Te	Hydrogen Telluride	h2te
152	H3O+	hydronium cation	h3o+
153	F-	Fluorine atom anion	f-
154	F+	Fluorine atom cation	f+
155	Cl-	Chlorine atom anion	cl-
156	Cl+	Chlorine atom cation	cl+
157	Mn	Manganese atom	mn
158	I	Iodine atom	iodine
159	I-	Iodine atom anion	iodine-
160	I+	Iodine atom cation	iodine+
161	DF	Hydrofluoric acid-d	df
162	DCl	Hydrochloric acid-d	dcl
163	HI	Hydrogen iodide	hi
164	HI+	Hydrogen iodide cation	hi+
165	H2F+	dihydrogen fluoride cation	h2f+
166	H2I+	Iodonium	h2i+
167	Ne-	Neon atom anion	ne-
168	Ne+	Neon atom cation	ne+
169	Ar	Argon atom	ar
170	Ar-	Argon atom anion	ar-
171	Ar+	Argon atom cation	ar+
172	Fe	Iron atom	fe
173	Xe	Xenon atom	xe
174	NeH	neon hydrogen	neh
175	NeH+	neon hydrogen cation	neh+
176	XeH+	Xenon, protonated	xeh+
177	H2Ar	H2 Ar dimer	h2ar
178	Co	Cobalt atom	cobalt
179	Ni	Nickel atom	ni
180	Li2	Lithium diatomic	li2
181	Li2-	lithium diatomic anion	li2-
182	Li2+	lithium diatomic cation	li2+
183	NaLi-	lithium sodium anion	lina-
184	NaLi+	lithium sodium cation	lina+
185	LiK	Lithium Potassium	lik
186	Na2+	sodium diatomic cation	na2+
187	NaK	Sodium Potassium	nak
188	NaK+	Sodium Potassium diatomic cation	nak+
189	K2	Potassium diatomic	k2
190	Cu2	Copper diatomic	cu2
191	LiBe	Lithium Beryllium	libe
192	LiMg	Lithium magnesium	limg
193	NaBe	Sodium Beryllium	nabe
194	NaMg	Sodium Magnesium	namg
195	Be2	Beryllium diatomic	be2
196	Be2-	Beryllium diatomic anion	be2-
197	Be2+	Beryllium diatomic cation	be2+
198	BeMg	Beryllium Magnesium	bemg
199	Mg2	Magnesium diatomic	mg2
200	Mg2-	magnesium diatomic anion	mg2-
201	Mg2+	magnesium diatomic cation	mg2+
202	Ca2	Calcium diatomic	ca2
203	LiB	Lithium boride	lib
204	NaAl	Sodium aluminum	naal
205	BeB	Beryllium monoboride	beb
206	B2	Boron diatomic	b2
207	B2-	Boron diatomic anion	b2-
208	B2+	Boron diatomic cation	b2+
209	BAl	Boron Aluminum	bal
210	Al2	Aluminum diatomic	al2
211	Al2-	aluminum diatomic anion	al2-
212	Al2+	aluminum diatomic cation	al2+
213	BGa	Boron Gallium	bga
214	AlGa	Aluminum Gallium	alga
215	Ga2	Gallium diatomic	ga2
216	LiBH4	Lithium borohydride	libh4
217	HBHHBH	Diborane(4) C2V	hbhhbh
218	Al2H6	dialane	al2h6
219	Ga2H6	digallane	ga2h6
220	LiC	Lithium Carbide	lic
221	BeC	Beryllium Carbide	bec
222	BC	boron monocarbide	bc
223	BC-	boron monocarbide anion	bc-
224	BC+	boron monocarbide cation	bc+
225	AlC	Aluminum carbide	alc
226	C2	Carbon diatomic	c2
227	C2-	carbon diatomic anion	c2-
228	C2+	carbon diatomic cation	c2+
229	SiC	silicon monocarbide	sic
230	SiC-	silicon monocarbide anion	sic-
231	SiC+	silicon monocarbide cation	sic+
232	Si2	Silicon diatomic	si2
233	Si2-	silcon diatomic anion	si2-
234	Si2+	silcon diatomic cation	si2+
235	Ge2	Germanium diatomic	ge2
236	C2H	Ethynyl radical	c2h
237	C2H+	Ethynyl cation	c2h+
238	ZnCH2	Zinc methylene	znch2
239	CCH2	vinylidene	vinylidene
240	CuCH3	monomethyl copper	cuch3
241	ZnCH3	Zinc monomethyl	znch3
242	CH2BH	methyleneborane	ch2bh
243	C2H3-	vinyl anion	c2h3-
244	C2H4-	Ethylene anion	c2h4-
245	CH3CH	methylmethylene	ch3ch
246	CH2SiH2	silaethylene	ch2sih2
247	CH3BH2	methylborane	ch3bh2
248	C2H5-	Ethyl anion	c2h5-
249	C2H5+	Ethyl cation	c2h5+
250	C2H6+	ethane cation	c2h6+
251	CH3SiH3	methyl silane	ch3sih3
252	GeH3CH3	methyl germane	geh3ch3
253	C2H7+	Ethane, protonated	c2h7+
254	LiN+	Lithium Nitride cation	lin+
255	BeN	Beryllium mononitride	ben
256	BeN-	Beryllium mononitride anion	ben-
257	BeN+	Beryllium mononitride cation	ben+
258	BN-	boron nitride anion	bn-
259	AlN-	aluminum mononitride anion	aln-
260	AlN+	aluminum mononitride cation	aln+
261	BP	Boron monophosphide	bp
262	AlP	Aluminum monophosphide	alp
263	GaN	Gallium mononitride	gan
264	GaP	Gallium monophosphide	gap
265	BN	boron nitride	bn
266	BN+	boron nitride cation	bn+
267	AlN	Aluminum nitride	aln
268	CN-	cyanide anion	cn-
269	CN+	Cyano cation	cn+
270	CP	Carbon monophosphide	cp
271	CP-	carbon monophosphide anion	cp-
272	CP+	carbon monophosphide cation	cp+
273	SiN	Silicon nitride	sin
274	SiN-	silicon mononitride anion	sin-
275	SiN+	silicon mononitride cation	sin+
276	SiP-	Silicon monophosphide anion	sip-
277	SiP+	Silicon monophosphide cation	sip+
278	TiN	Titanium mononitride	tin
279	N2-	nitrogen diatomic anion	n2-
280	N2+	diatomic nitrogen cation	n2+
281	PN-	phosphorus nitride anion	pn-
282	PN+	phosphorus nitride cation	pn+
283	P2	Phosphorus diatomic	p2
284	P2-	phosphorus diatomic anion	p2-
285	P2+	phosphorus diatomic cation	p2+
286	AsN	Arsenic mononitride	asn
287	AsP	Arsenic monophosphide	asp
288	SbN	Antimony nitride	sbn
289	As2	Arsenic diatomic	as2
290	HNB	hydrogen nitrogen boron	hnb
291	HNC	hydrogen isocyanide	hnc
292	HCN-	Hydrogen cyanide anion	hcn-
293	HCP	Phosphaethyne	hcp
294	NNH	Dinitrogen monohydride	nnh
295	HPO	Hydrogen phosphorus oxide	hpo
296	HPO+	Hydrogen phosphorus oxide cation	hpo+
297	CNH2	Aminomethylidyne radical	cnh2
298	CNH2+	N-protonated hydrogen isocyanide	cnh2+
299	H2CN	Dihydrogen cyanide radical	h2cn
300	H2CN+	hydrocyanonium cation	h2cn+
301	HCNH	methyleneazane	hcnh
302	HCNH+	N-protonated HCN	hcnh+
303	N2H2	(E)-diazene	n2h2
304	N2H2	(Z)-Diazene	n2h2z
305	CH2PH	Phosphaethene	ch3p
306	CH2NH2+	methyleneamine cation	ch2nh2+
307	N2H4+	hydrazine cation	n2h4+
308	P2H4	Diphosphine	p2h4
309	CH3NH2+	methyl amine cation	ch3nh2+
310	CH3PH2	Methyl phosphine	ch3ph2
311	N2H5+	protonated hydrazine	n2h5+
312	CH3NH3+	protonated methylamine	ch3nh3+
313	CH3PH3+	methyl phosphine, protonated	ch3ph3+
314	NH3NH3	Ammonia Dimer	nh3nh3
315	LiO	lithium oxide	lio
316	LiO-	lithium oxide anion	lio-
317	LiO+	lithium oxide cation	lio+
318	LiS	Lithium monosulfide	lis
319	LiS+	Lithium sulfide cation	lis+
320	NaO	sodium monoxide	nao
321	NaO-	sodium oxide anion	nao-
322	NaO+	sodium oxide cation	nao+
323	KO	Potassium monoxide	ko
324	KO+	Potassium monoxide cation	ko+
325	NaS	Sodium sulfide	nas
326	CuO	Copper Monoxide	cuo
327	BeO	beryllium oxide	beo
328	BeO-	Beryllium monoxide anion	beo-
329	BeO+	Beryllium monoxide cation	beo+
330	BeS	beryllium sulfide	bes
331	MgO	magnesium oxide	mgo
332	MgO-	magnesium oxide anion	mgo-
333	MgO+	magnesium oxide cation	mgo+
334	MgS	magnesium sulfide	mgs
335	MgS-	magnesium sulfide anion	mgs-
336	MgS+	magnesium sulfide cation	mgs+
337	ZnO	zinc monoxide	zno
338	ZnS	Zinc sulfide	zns
339	BeS-	Beryllium monosulfide anion	bes-
340	BeS+	Beryllium monosulfide cation	bes+
341	BO-	boron monoxide anion	bo-
342	AlO	Aluminum monoxide	alo
343	AlO-	Aluminum monoxide anion	alo-
344	AlO+	aluminum monoxide cation	alo+
345	BS	boron sulfide	bs
346	BS-	boron monosulfide anion	bs-
347	BS+	boron monosulfide cation	bs+
348	AlS	Aluminum sulfide	als
349	AlS-	aluminum monosulfide anion	als-
350	AlS+	aluminum monosulfide cation	als+
351	ScO	Scandium monoxide	sco
352	GaO	Gallium monoxide	gao
353	BO+	boron monoxide cation	bo+
354	CS	carbon monosulfide	cs
355	CS-	carbon monosulfide anion	cs-
356	CS+	carbon monosulfide cation	cs+
357	SiO-	silicon monoxide anion	sio-
358	SiO+	silicon monoxide cation	sio+
359	SiS-	silicon monosulfide anion	sis-
360	SiS+	silicon monosulfide cation	sis+
361	TiO	Titanium monoxide	tio
362	CSe-	Carbon monoselenide anion	cse-
363	CSe+	Carbon monoselenide cation	cse+
364	GeO+	Germanium monoxide cation	geo+
365	GeS	Germanium monosulfide	ges
366	NS	Mononitrogen monosulfide	ns
367	NS-	nitrogen sulfide anion	ns-
368	NS+	nitrogen sulfide cation	ns+
369	PO-	phosphorus monoxide anion	po-
370	PO+	phosphorus monoxide cation	po+
371	PS-	phosphorus monosulfide anion	ps-
372	PS+	phosphorus monosulfide cation	ps+
373	VO	Vanadium monoxide	vo
374	AsO	Arsenic monoxide	aso
375	O2-	oxygen diatomic anion	o2-
376	O2+	diatomic oxygen cation	o2+
377	SO-	sulfur monoxide anion	so-
378	S2-	sulfur diatomic anion	s2-
379	S2+	sulfur diatomic cation	s2+
380	SeO-	selenium monoxide anion	seo-
381	SeO+	selenium monoxide cation	seo+
382	SeS	Selenium monosulfide	ses
383	SeS-	selenium monosulfide anion	ses-
384	SeS+	selenium monosulfide cation	ses+
385	TeO	Tellurium monoxide	teo
386	Se2-	selenium diatomic anion	se2-
387	Se2+	selenium diatomic cation	se2+
388	Te2	Tellurium diatomic	te2
389	NaOH	sodium hydroxide	naoh
390	MgOH	magnesium hydroxide	mgoh
391	CaOH	Calcium monohydroxide	caoh
392	COH+	Carbon Monoxide, protonated	coh+
393	HCS	Thioformyl radical	hcs
394	HCS-	Thioformyl anion	hcs-
395	HCS+	Thioformyl cation	hcs+
396	HNO-	Nitrosyl hydride anion	hno-
397	NOH	Hydroxyimidogen	noh
398	NOH+	O-protonated nitric oxide	noh+
399	HNS	Sulfur imide	hns
400	HNS-	Sulfur imide anion	hns-
401	HO2	Hydroperoxy radical	ho2
402	HO2-	Hydroperoxy anion	ho2-
403	HO2+	Hydroperoxy cation	ho2+
404	HS2	Thiosulfeno radical	hs2
405	HOCH	hydroxycarbene	hoch
406	H2CS+	thioformaldehyde cation	h2cs+
407	H2NO	nitroxide	h2no
408	H2O2+	Hydrogen peroxide cation	h2o2+
409	H2S2	Disulfane	h2s2
410	H2S2+	hydrogen disulfide cation	h2s2+
411	CH2OH	Hydroxymethyl radical	ch2oh
412	CH3O	Methoxy radical	ch3o
413	CH3O+	Methoxy cation	ch3o+
414	CH3S	thiomethoxy	ch3s
415	H2CSH+	Thioformaldehyde, protonated	h2csh+
416	NH3O	Ammonia Oxide	nh3o
417	H2POH	Phosphinous acid	h2poh
418	H3PO	Phosphine oxide	h3po
419	H3O2+	hydrogen peroxide, protonated	h3o2+
420	CH3OH-	Methyl alcohol anion	ch3oh-
421	CH3SH+	Methanethiol cation	ch3sh+
422	CH3SeH	Methane selenol	ch3seh
423	H2OH2O	water dimer	h2oh2o
424	CH3OH2+	Methanol, protonated	ch3oh2+
425	CH3SH2+	protonated methylsulfide	ch3sh2+
426	H2ONH3	Water Ammonia Dimer	h2onh3
427	LiCl-	lithium chloride anion	licl-
428	LiCl+	lithium chloride cation	licl+
429	NaF	sodium fluoride	naf
430	NaF-	sodium fluoride anion	naf-
431	KF	Potassium Fluoride	kf
432	NaCl	Sodium Chloride	nacl
433	NaCl-	sodium chloride anion	nacl-
434	NaCl+	sodium chloride cation	nacl+
435	KCl	Potassium Chloride	kcl
436	CuF	Copper monofluoride	cuf
437	LiBr-	lithium bromide anion	libr-
438	LiBr+	lithium bromide cation	libr+
439	CuCl	Copper monochloride	cucl
440	NaBr	Sodium Bromide	nabr
441	NaBr-	sodium bromide anion	nabr-
442	NaBr+	sodium bromide cation	nabr+
443	KBr	Potassium Bromide	kbr
444	LiI	Lithium Iodide	lii
445	NaI	Sodium Iodide	nai
446	KI	Potassium Iodide	ki
447	LiF-	lithium fluoride anion	lif-
448	BeF	Beryllium monofluoride	bef
449	BeF-	Beryllium monofluoride anion	bef-
450	BeF+	Beryllium monofluoride cation	bef+
451	BeCl	beryllium monochloride	becl
452	MgF	Magnesium monofluoride	mgf
453	MgF-	magnesium fluoride anion	mgf-
454	MgF+	magnesium fluoride cation	mgf+
455	CaF	Calcium monofluoride	caf
456	MgCl	magnesium monochloride	mgcl
457	MgCl-	magnesium monochloride anion	mgcl-
458	MgCl+	magnesium monochloride cation	mgcl+
459	CaCl	calcium monochloride	cacl
460	TiCl	Titanium Monochloride	ticl
461	ZnF	Zinc monofluoride	znf
462	ZnF-	Zinc monofluoride anion	znf-
463	ZnF+	Zinc monofluoride cation	znf+
464	ZnCl	Zinc monochloride	zncl
465	BeCl-	beryllium monochloride anion	becl-
466	BeCl+	beryllium monochloride cation	becl+
467	BF-	Boron monofluoride anion	bf-
468	BF+	Boron monofluoride cation	bf+
469	AlF-	Aluminum monofluoride anion	alf-
470	AlF+	Aluminum monofluoride cation	alf+
471	BCl	boron monochloride	bcl
472	BCl-	boron monochloride anion	bcl-
473	BCl+	boron monochloride cation	bcl+
474	AlCl	Aluminum monochloride	alcl
475	AlCl-	aluminum monochloride anion	alcl-
476	AlCl+	aluminum monochloride cation	alcl+
477	ScF	Scandium monofluoride	scf
478	BBr	Boron monobromide	bbr
479	GaF+	Gallium monofluoride cation	gaf+
480	GaCl+	Gallium monochloride cation	gacl+
481	AlI	Aluminum monoiodide	ali
482	CF-	carbon monofluoride anion	cf-
483	CF+	carbon monofluoride cation	cf+
484	CCl	carbon monochloride	ccl
485	CCl-	carbon monochloride anion	ccl-
486	CCl+	carbon monochloride cation	ccl+
487	SiF	silicon monofluoride	sif
488	SiF-	silicon monofluoride anion	sif-
489	SiF+	silicon monofluoride cation	sif+
490	SiCl-	silicon monochloride anion	sicl-
491	SiCl+	silicon monochloride cation	sicl+
492	GeF+	Germanium monofluoride cation	gef+
493	NF	nitrogen fluoride	nf
494	NF-	nitrogen monofluorine anion	nf-
495	NF+	nitrogen monofluoirde cation	nf+
496	NCl-	nitrogen monochloride anion	ncl-
497	NCl+	nitrogen monochloride cation	ncl+
498	PF	phosphorus monofluoride	pf
499	PF-	phosphorus monofluoride anion	pf-
500	PF+	phosphorus monofluoride cation	pf+
501	PCl	phosphorus chloride	pcl
502	PCl-	phosphorus monochloride anion	pcl-
503	PCl+	phosphorus monochloride cation	pcl+
504	AsF	Arsenic monofluoride	asf
505	NBr	nitrogen monobromide	nbr
506	AsCl	Arsenic monochloride	ascl
507	SbF	Antimony monofluoride	sbf
508	SbCl	Antimony monochloride	sbcl
509	FO	Oxygen monofluoride	fo
510	FO-	flourine oxide anion	fo-
511	FO+	fluorine monoxide cation	fo+
512	ClO-	chlorine monoxide anion	clo-
513	SF-	sulfur monofluoride anion	sf-
514	SCl	sulfur monochloride	scl
515	SCl-	sulfur monochloride anion	scl-
516	BrO-	Bromine monoxide anion	bro-
517	SeF	Selenium monofluoride	sef
518	SeCl	Selenium monochloride	secl
519	IO	Iodine monoxide	io
520	F2-	flourine diatomic anion	f2-
521	ClF-	clorine monofluoride anion	clf-
522	Cl2-	chlorine diatomic anion	cl2-
523	BrF-	bromine fluoride anion	brf-
524	BrF+	bromine fluoride cation	brf+
525	BrCl-	bromine chloride anion	brcl-
526	BrCl+	bromine chloride cation	brcl+
527	IF	Iodine monofluoride	if
528	ICl	Iodine monochloride	icl
529	IBr	Iodine monobromide	ibr
530	I2	Iodine diatomic	i2
531	I2+	Iodine diatomic cation	i2+
532	HCCl	Chloromethylene	hccl
533	CHBr	bromomethylene	chbr
534	DOCl	Hypochlorous acid-d	docl
535	HOBr	Hypobromous acid	hobr
536	HOBr+	Hypobromous acid cation	hobr+
537	HOI	Hypoiodous acid	hoi
538	FHF	Hydrogen difluoride	fhf
539	FHF-	Hydrogen difluoride anion	fhf-
540	NH2F	monofluoroamine	nh2f
541	H2F2	Hydrogen fluoride dimer	h2f2
542	CD3F	methylfluoride-d3	cd3f
543	CD3Cl	methyl chloride d3	cd3cl
544	SiH3Br	bromosilane	sih3br
545	CH3I	methyl iodide	ch3i
546	SiH3I	Silyl Iodide	sih3i
547	Ne2	Neon diatomic	ne2
548	Ne2+	Neon diatomic cation	ne2+
549	Ar2+	Argon diatomic cation	ar2+
550	Li3	Lithium trimer	li3
551	Li3+	Lithium trimer cation	li3+
552	C3+	carbon trimer cation	c3+
553	C3H3	cyclopropenyl radical	cpr
554	C3H3	Propargyl radical	propargyl
555	C3H3-	Propargyl anion	c3h3-
556	C3H3+	cyclopropenyl cation	cpr+
557	C3H3+	Propargyl cation	c3h3+
558	C3H5+	Allyl cation	allyl+
559	CH3CHCH	1-propenyl radical	ch3chch
560	Zn(CH3)2	dimethyl zinc	dmz
561	C3H7+	cyclopropane, protonated	c3h7+
562	SiH2(CH3)2	dimethylsilane	dms
563	NaCN	Sodium Cyanide	nacn
564	CuCN	Copper cyanide	cucn
565	CN2	3H-Diazirin-3-ylidene	cn2
566	NCN	Cyanoimidogen	ncn
567	N3-	azide anion	n3-
568	N3+	azide cation	n3+
569	HCCN	cyanomethylene	hccn
570	HCNN	diazomethyl radical	hcnn
571	CH2N2	diazirine	ch2n2
572	CH2NN	diazomethane	ch2nn
573	NH2CN	cyanamide	cyanamide
574	CH3CN+	Acetonitrile cation	ch3cn+
575	CH3NC	methyl isocyanide	ch3nc
576	HNCNH2+	diiminomethane, protonated	hncnh2+
577	NCNH3+	Cyanamide, protonated	ncnh3+
578	CH2CHNH	vinylazine	ch2chnh
579	CH3CHN	methylmethaniminyl radical	ch3chn
580	NHCHNH2	aminomethanimine	cn2h4
581	C2H5N	Aziridine	c2h5n
582	CH2CHNH2	aminoethene	aminoethene
583	CH2NCH3	N-methylmethanimine	nmm
584	CH3CHNH	ethanimine	ethanimine
585	NH2BHNH2	diaminoborane	nh2bhnh2
586	C2H5NH+	Protonated Aziridine	c2h5nh+
587	NH2CH2NH2	diaminomethane	nh2ch2nh2
588	CH3NHCH3	Dimethylamine	ch3nhch3
589	CH3PHCH3	dimethylphosphine	ch3phch3
590	NH2CH2NH3+	diaminoethane, protonated	pdam
591	(CH3)2NH2+	dimethylammonium cation	dmam
592	CH3CH2NH3+	ethylamine, protonated	pea
593	Li2O+	dilithium oxide cation	li2o+
594	Li2S	dilithium sulfide	li2s
595	CCO	Dicarbon monoxide	cco
596	CNO-	fulminate	cno-
597	NCO-	cyanate	nco-
598	SCN	thiocyanato radical	scn
599	SCN-	thiocyanide anion	scn-
600	BO2	Boron dioxide	bo2
601	BO2-	Boron dioxide anion	bo2-
602	BO2+	Boron dioxide cation	bo2+
603	N2O-	Nitrous oxide anion	n2o-
604	N2O+	Nitrous oxide cation	n2o+
605	NNS	Nitrogen sulfide	nns
606	PPO	Phosphorus oxide phosphide	ppo
607	CO2-	Carbon dioxide anion	co2-
608	CO2+	Carbon dioxide cation	co2+
609	OCS+	Carbonyl sulfide cation	cos+
610	SiO2	silicon dioxide	sio2
611	CS2-	Carbon disulfide anion	cs2-
612	CS2+	Carbon disulfide cation	cs2+
613	TiO2	Titanium dioxide	tio2
614	SiS2	Silicon disulfide	sis2
615	GeS2	Germanium disulfide	ges2
616	CSe2	Carbon diselenide	cse2
617	SCTe	Carbon sulfide Telluride	scte
618	NO2-	Nitrogen dioxide anion	no2-
619	NO2+	Nitrogen dioxide cation	no2+
620	PO2	Phosphorus dioxide	po2
621	PO2-	Phosphorus dioxide anion	po2-
622	PO2+	Phosphorus dioxide cation	po2+
623	AsO2	Aresenic dioxide	aso2
624	O3	Ozone	o3
625	O3-	Ozone anion	o3-
626	O3+	Ozone cation	o3+
627	SO2-	Sulfur dioxide anion	so2-
628	SO2+	Sulfur dioxide cation	so2+
629	S3-	Sulfur trimer anion	s3-
630	S3+	Sulfur trimer cation	s3+
631	SeO2+	Selenium dioxide cation	seo2+
632	TeO2	Tellurium Dioxide	teo2
633	CS2H+	Carbon disulfide, protonated	cs2h+
634	HNCO	Isocyanic acid	hnco
635	HOCN	cyanic acid	hocn
636	HCO2-	formate anion	hco2-
637	HNNO	nitrosoazane	hnno
638	HNNO+	Nitrous oxide, N-protonated	hnno+
639	NNOH+	Nitrous Oxide, O-protonated	nnoh+
640	HCOO	formate neutral radical	hcoo
641	HOCO+	Hydrocarboxyl cation	hoco+
642	HNO2	Nitrous acid	hno2
643	HNO2+	nitrous acid cation	hno2+
644	SO2H+	protonated sulfur dioxide	so2h+
645	CH2CO+	Ketene cation	ch2co+
646	HCCOH	ethynol	hccoh
647	Mg(OH)2	Magnesium dihydroxide	h2mgo2
648	NH2NO	Nitrosamide	nh2no
649	CH2O2	Dioxirane	diox
650	H2O3	Hydrogen trioxide	h2o3
651	HSSSH	trisulfane	hsssh
652	NaOCH3	Sodium methoxide	naoch3
653	CH2BOH	hydroxy(methylene)borane	ch2boh
654	CH3BO	Borane, methyloxo-	ch3bo
655	CH2CHO	Vinyloxy radical	ch2cho
656	CH3CO	Acetyl radical	ch3co
657	CH3CO-	Acetyl anion	ch3co-
658	CH3CO+	acetyl cation	ch3co+
659	CH2NOH	formaldoxime	ch2noh
660	CH3NO	nitrosomethane	ch3no
661	CHONH2	formamide	formamide
662	CNOH3	1,2-oxaziridine	cnoh3
663	CH2OOH	CH2OOH radical	ch2ooh
664	CH3OO	methylperoxy radical	ch3oo
665	CH3OO-	methylperoxy anion	ch3oo-
666	CH3OO+	methylperoxy cation	ch3oo+
667	CH2CHOH	ethenol	ch2choh
668	H2CONH2+	protonated formamide	h2conh2+
669	NH3CHO+	Formamide, N-Protonated	nh3cho+
670	CH2(OH)2	methanediol	ch2o2h2
671	CH3OOH	Methyl peroxide	ch3ooh
672	H2OH2CO	water formaldehyde dimer	h2oh2co
673	CH2CH2OH	2-hydroxy ethyl radical	ch2ch2oh
674	CH3CH2O	Ethoxy radical	ethoxy
675	CH3CHOH	1-hydroxy-ethyl radical	ch3choh
676	CH3CHOH+	acetaldehyde, protonated	ch3choh+
677	CH3OCH2	methoxymethyl radical	ch3och2
678	CH3SeCH3	dimethylselenide	dmse
679	CH3OHH2O	methanol water dimer	ch3ohh2o
680	H2OCH3OH	water methanol dimer	h2och3oh
681	CuF2	Copper difluoride	cuf2
682	ZnF2	Zinc difluoride	znf2
683	FCN	Cyanogen fluoride	fcn
684	ClCN	chlorocyanogen	clcn
685	ICN	Cyanogen iodide	icn
686	BeF2	Beryllium fluoride	bef2
687	MgF2	Magnesium fluoride	mgf2
688	BeCl2	Beryllium chloride	becl2
689	MgCl2	Magnesium dichloride	mgcl2
690	CaCl2	Calcium Chloride	cacl2
691	ZnCl2	Zinc dichloride	zncl2
692	CaF2	Calcium difluoride	caf2
693	FCO	Carbonyl fluoride	fco
694	FCO+	Carbonyl fluoride cation	fco+
695	ClCO	carbonyl monochloride	clco
696	FNS	Thionitrosyl fluoride	fns
697	BrNO	Nitrosyl bromide	brno
698	INO	Nitrosyl iodide	ino
699	CF2-	Difluoromethylene anion	cf2-
700	CF2+	Difluoromethylene cation	cf2+
701	SiF2+	Silicon difluoride cation	sif2+
702	CCl2	dichloromethylene	ccl2
703	CCl2-	dichloromethylene anion	ccl2-
704	CCl2+	dichloromethylene cation	ccl2+
705	SiCl2	Dichlorosilylene	sicl2
706	GeF2	Germanium difluoride	gef2
707	FOO	Dioxygen monofluoride radical	foo
708	ClOO	chloroperoxy radical	cloo
709	ClOO+	chloroperoxy cation	cloo+
710	OClO+	Chlorine dioxide cation	oclo+
711	ClSO	Sulfur chloride oxide	clso
712	ClS2	Sulfur chloride	cls2
713	NF2	Difluoroamino radical	nf2
714	NF2+	Difluoroamino cation	nf2+
715	F2O	Difluorine monoxide	f2o
716	SF2-	sulfur difluoride anion	sf2-
717	SF2+	sulfur difluoride cation	sf2+
718	Cl2O	Dichlorine monoxide	cl2o
719	SCl2	Sulfur dichloride	scl2
720	BrOCl	Bromine hypochlorite	brocl
721	BrOBr	Bromine oxide	brobr
722	F3-	trifluoride anion	f3-
723	Cl3-	trichloride anion	cl3-
724	I3-	triiodide	i3-
725	HCCF+	fluoroacetylene cation	hccf+
726	HCCCl	Chloroacetylene	hcccl
727	HFCO	formyl fluoride	hfco
728	HFCO+	formyl fluoride cation	hfco+
729	COHCl	Formyl chloride	cohcl
730	COHBr	Formyl bromide	cohbr
731	BHF2	Difluoroborane	bhf2
732	BHCl2	Borane, dichloro-	bhcl2
733	CHCl2	dichloromethyl radical	chcl2
734	HOClO	Chlorous acid	hoclo
735	CH2FCl	fluorochloromethane	ch2fcl
736	CH2BrF	Methane, bromofluoro-	ch2fbr
737	CH2FI	fluoroiodomethane	ch2fi
738	CH2ClI	chloroiodomethane	ch2cli
739	CH2BrI	bromoiodomethane	ch2bri
740	CH2I2	Diiodomethane	ch2i2
741	SiH2Cl2	dichlorosilane	sih2cl2
742	CH2CHF+	fluoroethene cation	ch2chf+
743	C2H3Cl	Ethene, chloro-	ch2chcl
744	C2H3Br	vinyl bromide	c2h3br
745	C2H3I	Vinyl iodide	c2h3i
746	CH3OCl	methyl hypochlorite	ch3ocl
747	C2H5F	fluoroethane	c2h5f
748	CH3CH2Cl	Ethyl chloride	c2h5cl
749	CH3SiFH2	fluoromethylsilane	ch3sifh2
750	C2H5I	Ethyl iodide	c2h5i
751	KrF2	Krypton difluoride	krf2
752	XeF2	Xenon difluoride	xef2
753	B4H10	Tetraborane(10)	b4h10
754	C4+	Carbon tetramer cation	c4+
755	C4H2	Diacetylene	c4h2
756	C2H3CCH	1-Buten-3-yne	c2h3cch
757	C4H4	cyclobutadiene	cbd
758	H2CCCCH2	Butatriene	h2cccch2
759	C4H6	Cyclobutene	c822355
760	C4H6	Methylenecyclopropane	c6142730
761	CH2CCHCH3	1,2-Butadiene	butad12
762	CH2CHCHCH2	1,3-Butadiene	c106990
763	CH3CCCH3	2-Butyne	c503173
764	CHCCH2CH3	1-Butyne	c107006
765	CH3CHCHCH2	methylallyl radical	c4h7
766	C4H8	methylcyclopropane	mcp
767	CH2C(CH3)CH3	1-Propene, 2-methyl-	isobute
768	CH3CHCHCH3	2-Butene, (E)-	bute2e
769	CH3CHCHCH3	2-Butene, (Z)-	bute2z
770	B(CH3)3	trimethylborane	bme3
771	Al(CH3)3	trimethyl aluminum	tma
772	C(CH3)3	Tert-butyl radical	tbutyl
773	CH2CH(CH3)2	Isobutyl radical	isobutyl
774	CH3CHCH2CH3	2-Butyl radical	butyl2
775	CH3CH(CH3)CH3	Isobutane	isobutane
776	SiH(CH3)3	trimethylsilane	trimsi
777	Li3N	trilithium nitride	li3n
778	C2N2	Cyanogen	c2n2
779	C2N2+	Cyanogen cation	c2n2+
780	P4	Phosphorus tetramer	p4
781	HCCCN	Cyanoacetylene	hcccn
782	C3H3N	acrylonitrile	ch2chcn
783	C3H3N+	acrylonitrile cation	ch2chcn+
784	CH3N3	methyl azide	ch3n3
785	NH2CCNH2	Diaminoacetylene	daa
786	NH2CH2CN	Aminoacetonitrile	aan
787	CH3NHN2+	methyl azide, protonated	ch3nhn2+
788	CH5N3	Guanidine	guanidine
789	C4H6	Bicyclo[1.1.0]butane	c157335
790	CH3NNCH3	(Z)-1,2-Dimethyldiazene	dmdiazz
791	CH6N3+	guanidinium	ch6n3+
792	C3H7N	Cyclopropylamine	cpram
793	C3H7N	Azetidine	azet
794	C4H8	cyclobutane	cbutane
795	C2H8N2	Ethylenediamine	ethdiam
796	CH3NHNHCH3	dimethyl hydrazine	dmh
797	CH3CH(NH2)CH3	2-Propanamine	pram2
798	N(CH3)3	Trimethylamine	trimeam
799	P(CH3)3	trimethylphosphine	tmp
800	As(CH3)3	trimethyl arsine	tmas
801	(CH3)3NH+	protonated trimethyl amine	ptma
802	C3H7NH3+	n-propylamine, protonated	c3h7nh2
803	Li2O2	dilithium dioxide	li2o2
804	Na2O2	disodium dioxide	na2o2
805	C3O	Tricarbon monoxide	c3o
806	B2O2	Diboron dioxide	b2o2
807	CO3	Carbon trioxide	co3
808	CO3--	carbonate	co3--
809	NO3	Nitrogen trioxide	no3
810	NO3-	nitrate anion	no3-
811	NO3+	nitrogen trioxide cation	no3+
812	SO3-	Sulfur trioxide anion	so3-
813	SO3+	Sulfur trioxide cation	so3+
814	SeO3	selenium trioxide	seo3
815	TeO3	Tellurium trioxide	teo3
816	HCO3-	bicarbonate anion	hco3-
817	HSO3	Hydroxysulfonyl radical	hso3
818	NH2NO2	nitramide	nh2no2
819	C2H2CO	cyclopropenone	c2h2co
820	HCCCHO	2-propynal	hcccho
821	C2H2O2+	Ethanedial cation	c2h2o2+
822	H2CO3	Carbonic acid	h2co3
823	H2CS3	thiocarbonic acid	h2cs3
824	H2NO3+	Nitric Acid, Protonated	h2no3+
825	H2SO3	Sulfurous acid	h2so3
826	CH3COO-	acetate anion	ch3coo-
827	CH3ONO	Methyl nitrite	ch3ono
828	NH2COOH	Carbamic acid	nh2cooh
829	H3BO3	Boric acid	h3bo3
830	H3CO3+	carbonic acid, protonated	h3co3+
831	C3H4O	2-Propyn-1-ol	c107197
832	C3H4O	allenol	c9000071
833	C3H4O	Cyclopropanone	cpone
834	C3H4O	Methylketene	c6004440
835	NH2CONH2	Urea	urea
836	NH2CONH2+	Urea cation	urea+
837	NH2CSNH2	Thiourea	thiourea
838	C2H4O2	1,3-dioxetane	c2h4o2
839	CH3COOH	Acetic acid	ch3cooh
840	CH3OCHO	methyl formate	ch3ocho
841	CHOCH2OH	hydroxy acetaldehyde	haa
842	NH2COOH2+	Carbamic acid, O-protonated	nh2cooh2+
843	NH3COOH+	protonated Carbamic acid	nh3cooh+
844	H2OHCOOH	Water formic acid dimer 1	h2ohcooh_10
845	H2OHCOOH	Water formic acid dimer 2	h2ohcooh_11
846	HCOOHH2O	Formic acid water dimer	hcoohh2o
847	HOCH2OOH	hydroxy methyl peroxide	hoch2ooh
848	CH3COCH2	Acetonyl radical	ch3coch2
849	CH3CHNOH	Acetaldoxime	acetaldoxime
850	CH3CONH2	Acetamide	acetamide
851	HCONHCH3	N-methylformamide	nmfa
852	CH5N2O+	urea, N-protonated	ch4n2o+
853	H2NCOHNH2+	urea, protonated	ureah+
854	C2H5OO	ethylperoxy radical	c2h5oo
855	CH3NNCH3	(E)-1,2-Dimethyldiazene	dmdiaze
856	C3H5OH	Cyclopropanol	cproh
857	C3H6O	2-Propen-1-ol	c107186
858	C3H6O	Oxetane	oxetane
859	C3H6O	Propylene oxide	prox
860	CH3COCH3-	acetone anion	ch3coch3-
861	C3H6S	Thietane	thietane
862	C3H6S	Thiirane, methyl-	methiirane
863	CH3CSCH3	Thioacetone	ch3csch3
864	C2H6O2	1,2-Ethanediol	ethdiol
865	CH3OOCH3	dimethylperoxide	dmp
866	CH2SHCH2SH	1,2-Ethanedithiol	ethdisl
867	CH3SSCH3	Disulfide, dimethyl	ch3ssch3
868	CH3COHCH3+	acetone, protonated	acetoneh+
869	HOCH2CH2NH2	monoethanolamine	mea
870	CH3CHOHCH3	Isopropyl alcohol	isoproh
871	CH3OC2H5	Ethane, methoxy-	etome
872	C3H7SH	1-Propanethiol	prsh
873	CH3CHSHCH3	2-Propanethiol	isoprsh
874	CH3SCH2CH3	Ethane, (methylthio)-	etsme
875	H2OCH3OCH3	water dimethylether dimer	h2och3och3
876	Na2F2	Sodium Fluoride Dimer	na2f2
877	Na2Cl2	Disodium dichloride	na2cl2
878	C2F2	difluoroacetylene	c2f2
879	C2Cl2	dichloroacetylene	c2cl2
880	C2Cl2+	dichloroacetylene cation	c2cl2+
881	FNO2	Nitryl fluoride	fno2
882	FONO	Nitrosyl hypofluorite	fono
883	ClNO2	Nitryl chloride	clno2
884	ClONO	chlorine nitrite	clono
885	BrONO	Bromine nitrite	brono
886	N2F2	(Z)-Difluorodiazene	n2f2_z
887	N2F2	Dinitrogen difluoride, (E)-	n2f2_e
888	COFCl	Carbonic chloride fluoride	cofcl
889	CCl2O	Phosgene	cl2co
890	Cl2CS	Thiophosgene	cl2cs
891	COBr2	Carbonic dibromide	cobr2
892	BF3	Borane, trifluoro-	bf3
893	BF3-	Borane, trifluoro- anion	bf3-
894	AlF3	Aluminum trifluoride	alf3
895	AlF2Cl	Aluminum chloride difluoride	alclf2
896	ScF3	Scandium trifluoride	ScF3
897	AlFCl2	Aluminum dichloride fluoride	alcl2f
898	AlCl3	Aluminum trichloride	alcl3
899	BBr3	Boron tribromide	bbr3
900	AlBr3	Aluminum Bromide	albr3
901	ClO3	Chlorine trioxide	clo3
902	ClO3-	chlorate anion	clo3-
903	BrO3-	Bromate anion	bro3-
904	CF3	Trifluoromethyl radical	cf3
905	CF3-	Trifluoromethyl anion	cf3-
906	CF3+	Trifluoromethyl cation	cf3+
907	SiF3	Silicon trifluoride radical	sif3
908	SiF3+	Silicon trifluoride cation	sif3+
909	CCl3	Trichloromethyl radical	ccl3
910	CCl3-	Trichloromethyl anion	ccl3-
911	CCl3+	Trichloromethyl cation	ccl3+
912	SiCl3	trichlorosilyl radical	sicl3
913	SiCl3+	trichlorosilyl cation	sicl3+
914	FOOF	Perfluoroperoxide	foof
915	F2SO	Thionyl Fluoride	f2so
916	ClOOCl	Dichlorine dioxide	cloocl
917	FSSF	Difluorodisulfane	fssf
918	S2F2	Thio-thionyl fluoride	s2f2
919	SOCl2	thionyl chloride	socl2
920	SeOCl2	selenium oxychloride	seocl2
921	NF3-	Nitrogen trifluoride anion	nf3-
922	NF3+	Nitrogen trifluoride cation	nf3+
923	PF3	Phosphorus trifluoride	pf3
924	AsF3	Arsenic trifluoride	asf3
925	PCl3	Phosphorus trichloride	pcl3
926	SbF3	Antimony Trifluoride	sbf3
927	AsCl3	Arsenous trichloride	ascl3
928	SbCl3	Antimony Trichloride	sbcl3
929	PBr3	Phosphorus tribromide	pbr3
930	AsBr3	Arsenic tribromide	asbr3
931	NI3	Nitrogen triiodide	ni3
932	PI3	Phosphorus triiodide	pi3
933	ClSSCl	Disulfur dichloride	s2cl2
934	SF3	Sulfur trifluoride	sf3
935	ClF3	Chlorine trifluoride	clf3
936	BrF3	Bromine trifluoride	brf3
937	IF3	iodone trifluoride	if3
938	CHF2Cl	difluorochloromethane	chf2cl
939	CHFCl2	fluorodichloromethane	chfcl2
940	CDCl3	trichloromethane-d	cdcl3
941	CHCl3	Chloroform	chcl3
942	SiHCl3	Trichlorosilane	sihcl3
943	CHF2I	difluoroiodomethane	chf2i
944	CHFClI	fluorochloroiodomethane	chfcli
945	CHCl2I	dichloroiodomethane	chcl2i
946	CHClBr2	Methane, dibromochloro-	chclbr2
947	CHBr3	bromoform	chbr3
948	CHI3	Iodoform	chi3
949	NF3H+	protonated nitrogen trifluoride	nf3h+
950	C2H2F2	Ethene, 1,2-difluoro-, (E)-	c2h2f2e
951	C2H2F2	Ethene, 1,2-difluoro-, (Z)-	c2h2f2z
952	CH2CF2	Ethene, 1,1-difluoro-	ch2cf2
953	CH2CCl2	Ethene, 1,1-dichloro-	ch2ccl2
954	CHClCHCl	Ethene, 1,2-dichloro-, (E)-	chclchcle
955	CHClCHCl	Ethene, 1,2-dichloro-, (Z)-	chclchclz
956	C2H2Br2	1,1-dibromoethene	c2h2br2
957	CH2FCHO	Fluoroacetaldehyde	ch2fcho
958	CH3COF	Acetyl fluoride	ch3cof
959	CH2ClCHO	chloroacetaldehyde	ch2clcho
960	CH3COCl	Acetyl Chloride	ch3cocl
961	CH2FCH2Cl	Ethane, 1-chloro-2-fluoro-	ch2fch2cl
962	CH3CHFCl	Ethane, 1-chloro-1-fluoro-	ch3chfcl
963	CH2ClCH2Cl	Ethane, 1,2-dichloro-	ch2clch2cl
964	CH3CHCl2	Ethane, 1,1-dichloro-	ch3chcl2
965	CH2CFCH3	2-fluoropropene	2fpro
966	C3H5Cl	1-Propene, 3-chloro-	prop1cl3
967	C3H5Cl	1-chloro-1-propene(E)	prop1cl1e
968	C3H5Cl	1-chloro-1-propene(Z)	prop1cl1z
969	CH2ClCH2OH	2-Chloroethanol	ch2clch2oh
970	CH2ClCH2OH2+	2-chloroethanol, protonated	ch2clch2oh2+
971	CH2ClCH2CH3	Propane, 1-chloro-	prcl1
972	CH3CH2CH2Br	n-propyl bromide	prbr
973	CH3CHBrCH3	i-propyl bromide	iprbr
974	C3H9O+	trimethyl oxonium cation	c3h9o+
975	C5H5	cyclopentadienyl radical	c5h5
976	C5H5-	cylopentadienyl anion	c5h5-
977	C5H6	1,3-Cyclopentadiene	c542927
978	C5H6	1-Buten-3-yne, 2-methyl-	c78808
979	C5H6	3-Penten-1-yne, (E)-	c2004695
980	C5H6	3-Penten-1-yne, (Z)-	c1574409
981	C5H6	Bicyclo[2.1.0]pent-2-ene	c5164352
982	C5H6	Cyclopropylacetylene	c6746947
983	C5H7	1,3-pentadienyl radical	pdyl
984	C5H7	cyclopentenyl radical	cpyl
985	C5H8	1,2-Butadiene, 3-methyl-	c598254
986	C5H8	1,2-Pentadiene	c591957
987	C5H8	1,3-Butadiene, 2-methyl-	c78795
988	C5H8	1,3-Pentadiene, (E)-	c2004708
989	C5H8	1,3-Pentadiene, (Z)-	c1574410
990	C5H8	1,4-Pentadiene	c591935
991	C5H8	1-pentyne	a1pentyne
992	C5H8	2,3-Pentadiene	c591968
993	C5H8	Cyclobutane, methylene-	c1120565
994	C5H8	Cyclopentene	c142290
995	C5H8	Ethenylcyclopropane	c693867
996	CH3CCCH2CH3	2-Pentyne	2pentyne
997	C5H10	1-Butene, 2-methyl-	c563462
998	C5H10	2-Butene, 2-methyl-	c513359
999	C5H10	2-Pentene, (E)-	c646048
1000	C5H10	2-Pentene, (Z)-	c627203
1001	C5H10	Cyclopentane	c287923
1002	C5H10	Cyclopropane, 1,1-dimethyl-	c1630940
1003	CH2CHCH2CH2CH3	1-pentene	pentene
1004	C5H11	2-Methylbut-2-yl radical	c4348350
1005	C5H12	Butane, 2-methyl-	buta2
1006	C5H12	Pentane	pentane
1007	C5H12	Propane, 2,2-dimethyl-	neopentane
1008	Si(CH3)4	tetramethylsilane	tms
1009	N2O3	Dinitrogen trioxide	n2o3
1010	C3H2N2	Malononitrile	c3h2n2
1011	CH2N4	1H-Tetrazole	1htz
1012	C3H3N2	imidazolyl radical	im
1013	C3H3N2-	imidizolyl anion	im-
1014	C2H3N3	1H-1,2,4-Triazole	c288880
1015	C4H4N	pyrrolide radical	c4h4n
1016	C4H4N-	pyrrolide anion	c4h4n-
1017	C3H4N2	1H-Imidazole	1himidaz
1018	C3H4N2	1H-Pyrazole	1hpyraz
1019	C3H4N2	4H-Imidazole	imid4h
1020	C4H5N	(E)-2-Butenenitrile	c627269
1021	C4H5N	(Z)-2-Butenenitrile	c1190767
1022	C4H5N	2H-pyrrole	pyrrole2
1023	C4H5N	3H-pyrrole	pyrrole3
1024	C4H5N	Cyclopropanecarbonitrile	c5500210
1025	CH2CHCH2CN	Allylcyanide	ch2chch2cn
1026	C4H6N+	pyrrole, alpha-protonated	appyr
1027	C4H6N+	pyrrole, beta-protonated	bppyr
1028	C4H6N+	pyrrole, protonated	ppyr
1029	C3H6N2	3-Aminopropionitrile	c151188
1030	CH3CH(CH3)CN	Propanenitrile, 2-methyl-	c4h7n
1031	CH3CH2CH2CN	Butanenitrile	c109740
1032	C5H8	Bicyclo[2.1.0]pentane	c185944
1033	C5H8	Spiropentane	c157404
1034	C4H9N	Cyclobutylamine	cbam
1035	C4H9N	Pyrrolidine	pyrrolidine
1036	C3H10N2	1,2-Diaminopropane	diampr12
1037	C(CH3)3NH2	2-Propanamine, 2-methyl-	c75649
1038	C(NH2)H2C(CH3)HCH3	1-Propanamine, 2-methyl-	c78819
1039	C(NH2)H2CH2CH2CH3	1-Butanamine	butam1
1040	CH3C(NH2)HCH2CH3	2-Butanamine	butam2
1041	NH(C2H5)2	diethylamine	dea
1042	NC4H12+	tetramethyl ammonium cation	nc4h12+
1043	C3O2+	Carbon suboxide cation	c3o2+
1044	MgCO3	Magnesium Carbonate	mgco3
1045	BeCO3	Beryllium Carbonate	beco3
1046	CaCO3	Calcium Carbonate	caco3
1047	ONONO	Nitrosyl nitrite	onono
1048	PO4---	phosphate	po4---
1049	SO4--	sulfate	so4--
1050	HOONO2	peroxy nitric acid	hoono2
1051	HSO4-	bisulfate anion	hso4-
1052	C2H2N2S	1,3,4-Thiadiazole	c2h2n2s
1053	C3H2O2	Propiolic acid	c3h2o2
1054	CHOCOOH	oxo acetic acid	oaa
1055	H2SO4	Sulfuric acid	h2so4
1056	H2SeO4	Selenic acid	h2seo4
1057	C3H3NO	Oxazole	oxazole
1058	CH3C(O)OO	acetyl peroxy radical	ch3coo2
1059	CH3NO3	Methyl nitrate	ch3no3
1060	H3PO4	Phosphoric Acid	h3po4
1061	C4H4O	Furan	furan
1062	C4H4O+	Furan cation	furan+
1063	C4H4S	Thiophene	furans
1064	C3H4O2	β–Propiolactone	beta
1065	C3H4O2	2-Propenoic acid	propenoic2
1066	C3H4O2	Methyl glyoxal	megly
1067	C3H4O2	propanedial	propanedial
1068	C3H4O2	propenalol	propenalol
1069	HOCHCCHOH	allenediol	aldiol
1070	C2H4O3	1,2,3-trioxolane	c2h4o3
1071	C2H4O3	trioxolane124	triox
1072	HOCH2COOH	Hydroxyacetic acid	hac
1073	CH2CHCONH2	Acrylamide	c79061
1074	CH3OCH2CN	Methoxyacetonitrile	c1738369
1075	CH5N3S	Hydrazinecarbothioamide	c79196
1076	H2NCH2COOH	Glycine	glycine
1077	CH3SO2NH2	methanesulfonamide	ch3so2nh2
1078	C4H6O	cis-2-butenal	butenal2c
1079	C4H6O	Cyclobutanone	cbutone
1080	C4H6O	Furan, 2,3-dihydro-	furan23h
1081	C4H6O	Furan, 2,5-dihydro-	furan25h
1082	CH2CHOCHCH2	Vinyl ether	vinylether
1083	CHOCHCHCH3	2-Butenal	butenal2
1084	C4H6S	Thiophene, 2,3-dihydro-	thiop23h
1085	C4H6S	Thiophene, 2,5-dihydro-	thiop25h
1086	CH2CHSCHCH2	Divinyl sulfide	divis
1087	C2H6N2O	Urea, methyl-	c598505
1088	C3H6O2	1,3-Dioxolane	dioxolane
1089	CH3CH2COOH	Propanoic Acid	propanoic
1090	CH3COOCH3	methyl acetate	aame
1091	CH3SSSCH3	dimethyl trisulfide	c2h6s3
1092	C3H7NO	dimethylformamide	dmf
1093	C3H7NO	Propanamide	propanam
1094	C2H3OC2H5	Ethene, ethoxy-	c109922
1095	C4H8O	Cyclobutanol	c2919235
1096	C4H8O	Furan, tetrahydro-	thf
1097	CH2C(CH3)OCH3	1-Propene, 2-methoxy-	pre1meo2
1098	CH3COCH2CH3	2-Butanone	buta2one
1099	CHOCH(CH3)CH3	Propanal, 2-methyl-	c78842
1100	CHOCH2CH2CH3	Butanal	butanal
1101	C3H8O2	1,3-Propanediol	c504632
1102	C3H8O2	Hydroperoxide, 1-methylethyl	c3031752
1103	C3H8O2	Methane, dimethoxy-	c109875
1104	C3H8O2	Propylene glycol	c57556
1105	C3H8S2	1,3-Propanedithiol	c109808
1106	C4H10O	1-Butanol	butanol1
1107	C4H10O	1-Propanol, 2-methyl-	c78831
1108	C4H10O	2-Butanol, (.+/-.)-	butanol2
1109	C4H10O	Ethanol, 1,1-dimethyl-	tbuoh
1110	C4H10O	Propane, 2-methoxy-	c598538
1111	C4H10O+	1-Butanol cation	butanol1+
1112	C2H5SC2H5	Diethyl sulfide	etset
1113	CH2(SH)CH(CH3)CH3	1-Propanethiol, 2-methyl-	c513440
1114	CH3C(SCH3)HCH3	Propane, 2-(methylthio)-	mesipr
1115	CH3CH(SH)CH2CH3	2-Butanethiol	butansl2
1116	FNO3	Fluorine nitrate	fno3
1117	ClONO2	Chlorine nitrate	clono2
1118	BrONO2	Bromine nitrate	brono2
1119	TiCl4	Titanium tetrachloride	ticl4
1120	ClO4-	perchlorate anion	clo4-
1121	BF4-	tetrafluoroboron anion	bf4-
1122	ClFO3	Perchloryl fluoride	clfo3
1123	SO2F2	Sulfuryl fluoride	so2f2
1124	SO2Cl2	Sulfuryl chloride	so2cl2
1125	F3NO	Nitrogen trifluoride oxide	f3no
1126	F3PO	Phosphoryl fluoride	pf3o
1127	Cl3PO	Phosphoryl chloride	pcl3o
1128	CF4	Carbon tetrafluoride	cf4
1129	SiF4	Silicon tetrafluoride	sif4
1130	TiF4	Titanium tetrafluoride	tif4
1131	CFCl3	Trichloromonofluoromethane	cfcl3
1132	CCl4+	Carbon tetrachloride cation	ccl4+
1133	CBrClF2	Methane, bromochlorodifluoro-	cbrclf2
1134	SiCl4	Silane, tetrachloro-	sicl4
1135	CF3I	trifluoroiodomethane	cf3i
1136	CBrCl3	Methane, bromotrichloro-	cbrcl3
1137	CBr2F2	Methane, dibromodifluoro-	cbr2f2
1138	GeCl4	Germanium Tetrachloride	gecl4
1139	CCl3I	trichloroiodomethane	ccl3i
1140	CFBr3	fluorotribromomethane	cfbr3
1141	CFClBrI	fluorochlorobromoiodomethane	cfclbri
1142	CF2I2	difluorodiiodomethane	cf2i2
1143	CCl2I2	dichlorodiiodomethane	ccl2i2
1144	SiBr4	Silicon tetrabromide	sibr4
1145	CBr3I	tribromoiododmethane	cbr3i
1146	CI4	tetraiodomethane	ci4
1147	SiI4	silicon tetraiodide	sii4
1148	ClOF3	Chlorine trifluoride oxide	clof3
1149	C2HF3	Trifluoroethylene	c2hf3
1150	C2HF3+	Trifluoroethylene cation	c2hf3+
1151	CHClCCl2	Trichloroethylene	chclccl2
1152	CHBrCF2	1-Bromo-2,2-difluoroethylene	chbrcf2
1153	HClO4	perchloric acid	hclo4
1154	HSO3F	Fluorosulfonic acid	hso3f
1155	CF3OH	trifluoromethanol	cf3oh
1156	CHClCCHCl	1,3-dichloroallene	chclcchcl
1157	PF3CH2	phosphorane, trifluoromethylene-	pf3ch2
1158	CH3CF3	Ethane, 1,1,1-trifluoro-	ch3cf3
1159	CH3CF2Cl	1-Chloro-1,1-Difluoroethane	ch3cf2cl
1160	CH3CFCl2	1,1-Dichloro-1-fluoroethane	ch3cfcl2
1161	CH2ClCHCl2	1,1,2-trichloroethane	ch2clchcl2
1162	CH3CCl3	Ethane, 1,1,1-trichloro-	ch3ccl3
1163	SiCl3CH3	methyltrichlorosilane	sicl3ch3
1164	CH3CBr3	1,1,1-tribromoethane	ch3cbr3
1165	NH3BCl3	Amminetrichloroboron	nh3bcl3
1166	SiH3CCl3	(trichloromethyl)silane	sih3ccl3
1167	C3H5ClO	Oxirane, (chloromethyl)-	c106898
1168	CH3CF2CH3	2,2-difluoropropane	ch3cf2ch3
1169	CH2ClCH2CH2Cl	1,3-dichloropropane	prdicl13
1170	CH2ClCHClCH3	Propane, 1,2-dichloro-	prdicl12
1171	CHCl2CH2CH3	1,1-dichloropropane	prdicl11
1172	SiCl2(CH3)2	dichlorodimethylsilane	sicl2me2
1173	CH2CClCH2CH3	1-Butene, 2-chloro-	bute1cl2
1174	CH2CHCH2CH2Cl	1-Butene, 4-chloro-	bute1cl4
1175	CH2CHCHClCH3	1-Butene, 3-chloro-	bute1cl3
1176	CH2ClCHCHCH3	2-Butene, 1-chloro-	bute2cl1
1177	CH3CClCHCH3	2-Butene, 2-chloro-, (E)-	bute2cl2e
1178	CH3CClCHCH3	2-Butene, 2-chloro-, (Z)-	bute2cl2z
1179	CHClCHCH2CH3	(E)-1-Chloro-1-butene	bute1cl1
1180	CHClCHCH2CH3	(Z)-1-Chloro-1-butene	bute1cl1z
1181	C4H9F	1-fluorobutane	butaf1
1182	CH3CHFCH2CH3	2-fluorobutane	butaf2
1183	CH2ClCH2CH2CH3	Butane, 1-chloro-	butacl1
1184	CH3CCl(CH3)CH3	Propane, 2-chloro-2-methyl-	procl2me2
1185	CH3CHClCH2CH3	Butane, 2-chloro-	butacl2
1186	XeF4	Xenon tetrafluoride	xef4
1187	CF3PH2	phosphine, (trifluoromethyl)-	cf3ph2
1188	NH3BF3	Amminetrifluoroboron	nh3bf3
1189	C6H2	hexatriyne	c6h2
1190	C6H4	(E)-Hexa-1,5-diyne-3-ene	c6h4e
1191	C6H4	(Z)-Hexa-1,5-diyne-3-ene	c6h4z
1192	C6H4	Benzyne	benzyne
1193	C6H5	phenyl	phenyl
1194	C6H5-	phenyl anion	phenyl-
1195	C6H6	2,4-Hexadiyne	hexadiyne
1196	C6H6	3,4-Dimethylenecyclobutene	cb34m
1197	C6H6	Hexa-1,5-diene-3-yne	hdy153
1198	C6H6	Trimethylenecycopropane	tmcp
1199	C6H6+	Benzene cation	c6h6+
1200	C6H7+	benzene, protonated	c6h7+
1201	C6H8	(E)-hexa-1,3,5-triene	c821078
1202	C6H8	(E)-hexa-2,3,4-triene	c59660650
1203	C6H8	(Z)-hexa-1,3,5-triene	hexatri135
1204	C6H8	(Z)-hexa-2,3,4-triene	hetr234c
1205	C6H8	1,3-Cyclohexadiene	cyhexadiene13
1206	C6H8	1,4-Cyclohexadiene	cyhexadiene14
1207	C6H8	3-Methylenecyclopentene	c930267
1208	C6H8	Bicyclo[2.1.1]hex-2-ene	c822413
1209	C6H8	Bicyclo[2.2.0]hex-1(4)-ene	c30830207
1210	C6H8	Bicyclo[3.1.0]hex-2-ene	c694019
1211	C6H10	1,3-Hexadiene, (E)-	hexdi13e
1212	C6H10	1,3-Hexadiene, (Z)-	hexdi13z
1213	C6H10	1,4-Hexadiene, (E)-	hexdi14t
1214	C6H10	1,4-Hexadiene, (Z)-	hexdi14z
1215	C6H10	1,5-Hexadiene	c592427
1216	C6H10	1-Butyne, 3,3-dimethyl-	c917920
1217	C6H10	1-Hexyne	hexyne1
1218	C6H10	2,4-Hexadiene, (E,E)-	hexdi24ee
1219	C6H10	2,4-Hexadiene, (E,Z)-	hexdi24ez
1220	C6H10	2,4-Hexadiene, (Z,Z)-	hexdi24zz
1221	C6H10	2-Hexyne	c764352
1222	C6H10	3-Hexyne	hexyne3
1223	C6H10	cyclohexene	cyclohexene
1224	C6H10	Cyclopentene, 1-methyl-	c693890
1225	C6H10	Cyclopentene, 3-methyl-	c1120623
1226	C6H10	Cyclopentene, 4-methyl-	c1759815
1227	C4H6(CH3)2	1,1-dimethylcyclobutane	dmcb11
1228	C6H12	(1R,2R)-1,2-dimethylcyclobutane	dmcb12t
1229	C6H12	(1r,3r)-1,3-dimethylcyclobutane	dmcb13t
1230	C6H12	(E)-2-Hexene	e2hexene
1231	C6H12	(E)-3-methylpent-2-ene	c616126
1232	C6H12	(E)-hex-3-ene	e3hexene
1233	C6H12	(Z)-3-methylpent-2-ene	c922623
1234	C6H12	(Z)-hex-2-ene	z2hexene
1235	C6H12	(Z)-hex-3-ene	z3hexene
1236	C6H12	2,3-dimethylbut-1-ene	c563780
1237	C6H12	2,3-dimethyl-but-2-ene	tmeet
1238	C6H12	3-methylenepentane	c760214
1239	C6H12	cis-1,2-dimethylcyclobutane	dmcb12c
1240	C6H12	cis-1,3-dimethylcyclobutane	dmcb13c
1241	C6H12	Cyclohexane	cyclohexane
1242	C6H12	Cyclopentane, methyl-	c96377
1243	C6H12	Ethylcyclobutane	c4806615
1244	C6H12	hex-1-ene	hexene1
1245	C6H14	Butane, 2,2-dimethyl-	buta22
1246	C6H14	Butane, 2,3-dimethyl-	buta23
1247	C6H14	Hexane	hexane
1248	C6H14	Pentane, 2-methyl-	penta2
1249	C6H14	Pentane, 3-methyl-	penta3
1250	C4N2	2-Butynedinitrile	c4n2
1251	C4H2N2	Fumaronitrile	c4h2n2
1252	C2H2N4	sym-tetrazine	ttz
1253	C3H3N3	1,3,5-Triazine	triazine135
1254	CH3N5	5-Aminotetrazole	c4418615
1255	C4H4N2	1,3-Diazine	diazine13
1256	C4H4N2	Pyrazine	pyrazine
1257	C4H4N2	Pyridazine	pyridazine
1258	C4H4N2	Succinonitrile	c110612
1259	C2H4N4	1H-Tetrazole, 1-methyl-	c16681779
1260	C2H4N4	1H-Tetrazole, 5-methyl-	c4076362
1261	C2H4N4	2H-Tetrazole, 2-methyl-	c16681780
1262	C5H5N	Bicyclo[1.1.0]butane-1-carbonitrile	bibucn
1263	C5H5N	E-2,4-pentadienenitrile	bdcn
1264	C5H5N	Pyridine	pyridine
1265	B3N3H6	borazine	borazine
1266	C6H6	Fulvene	fulvene
1267	C5H6N+	Pyridinium	c5h6n
1268	C4H6N2	1H-Imidazole, 2-methyl-	c693981
1269	C5H7N	(E)-2-Pentenenitrile	c26294984
1270	C5H7N	(E)-3-Pentenenitrile	c16529661
1271	C5H7N	(Z)-2-Pentenenitrile	c25899507
1272	C5H7N	1H-Pyrrole, 1-methyl-	c96548
1273	C5H7N	Cyclobutanecarbonitrile	c4426113
1274	C5H9N	1,2,3,6-Tetrahydropyridine	c694053
1275	C5H9N	Butanenitrile, 2-methyl-	c18936179
1276	C5H9N	Pentanenitrile	c110598
1277	C5H9N	Propanenitrile, 2,2-dimethyl-	c630182
1278	C6H10	Bicyclo[3.1.0]hexane	c285585
1279	C5H11N	Cyclopentanamine	cypentam
1280	C5H11N	Piperidine	piper
1281	C4H12N2	1,2-Butanediamine	c4426486
1282	C4H12N2	2-Methyl-1,2-propanediamine	c811938
1283	Li2CO3	Lithium Carbonate	li2co3
1284	Na2CO3	Sodium Carbonate	na2co3
1285	C2O4--	oxalate anion	c2o4
1286	MgSO4	Magnesium Sulfate	mgso4
1287	N2O4	Dinitrogen tetroxide	n2o4
1288	C2H2O4	Oxalic Acid	oxalic
1289	C2H3NO3	Oxamic acid	oxamic
1290	C4H4O2	2(5H)-Furanone	furanone
1291	C4H4O2	2-Oxetanone, 4-methylene-	c674828
1292	C2H4N2O2	Oxalamide	oxalamide
1293	C2H4N2S2	Ethanedithioamide	c79403
1294	C2H4CO3	Ethylene carbonate	etco3
1295	C3H4O2S	2H-Thiete-1,1-dioxide	c7285327
1296	C3H4S3	1,3-Dithiolane-2-thione	c822388
1297	C2H4O4	Formic acid dimer	fadimer
1298	C4H5NO	3-Methylisoxazole	isox3m
1299	C4H5NO	Isoxazole, 5-methyl-	c5765446
1300	C4H5NS	4-Methylthiazole	c693958
1301	C2H5NO3	Nitric acid, ethyl ester	c625581
1302	C5H6O	2-methylfuran	furan2m
1303	C5H6O	3-Methylfuran	furan3m
1304	C5H6S	Thiophene, 2-methyl-	c554143
1305	C5H6S	Thiophene, 3-methyl-	c616444
1306	C4H6O2	2,3-Butanedione	c431038
1307	C4H6O2	2-Propenoic acid, methyl ester	c96333
1308	C4H6O2	Crotonic Acid	crot
1309	C4H6OS	2,3-dihydrothiophene-2-ol	c9000117
1310	C4H6OS	2,5-dihydrothiophene-3-ol	c9000093
1311	C4H6OS	4,5-dihydrothiophene-2-ol	c9000106
1312	C4H6OS	4,5-dihydrothiophene-3-ol	c9000082
1313	C4H6OS	Dihydro-2-(3H)-thiophenone	c1003107
1314	C4H6OS	Dihydro-3-(2H)-thiophenone	c1003049
1315	C4H6OS	Vinyl sulfoxide	c1115157
1316	CH6N4S	Carbonothioic dihydrazide	thiacarb
1317	C2H6N2O2	(E)-Azodioxymethane	c37765154
1318	C2H6N2O2	Dimethylnitroamine	c4164287
1319	C3H6S3	1,3,5-Trithiane	c3h6s3
1320	C3H6S3	Carbonotrithioic acid, dimethyl ester	c2314489
1321	C2H6O3S	Sulfurous acid, dimethyl ester	c616422
1322	C4H7NO	2-Pyrrolidinone	c616455
1323	C4H7NO	Ethoxyacetonitrile	etoaccn
1324	C4H7NO	Methacrylamide	c79390
1325	C4H7NO	Oxazole, 4,5-dihydro-2-methyl-	c1120645
1326	HCONH2CN2H4	formamide aminomethanimine dimer	d13
1327	C3H7ONO	Propyl nitrite	prono
1328	CH3CH(CH3)ONO	Isopropyl nitrite	c541424
1329	CH3CH(NH2)COOH	Alanine	alanine
1330	CH3NHCH2COOH	Sarcosine	sarcosine
1331	NH2CH2CH2COOH	β–alanine	betaalanine
1332	NH2COOC2H5	Urethane	urethane
1333	C5H8O	2H-Pyran, 3,4-dihydro-	c110872
1334	C5H8O	Cyclopentanone	c120923
1335	C5H8O	Furan, 2,3-dihydro-5-methyl-	c1487156
1336	C5H8O	Methyl cyclopropyl ketone	c765435
1337	N(CH3)2CONH2	Urea, N,N-dimethyl-	c598947
1338	NH(CH3)CONH(CH3)	Urea, N,N'-dimethyl-	c96311
1339	NH2CONHC2H5	Urea, ethyl-	c625525
1340	C4H8O2	1,3-Dioxane	dioxan13
1341	C4H8O2	1,3-Dioxolane, 2-methyl-	c497267
1342	C4H8O2	1,4-Dioxane	dioxan14
1343	C4H8O2	Ethene, 1,1-dimethoxy-	c922690
1344	C4H8OS	s-Ethyl thioacetate	c625605
1345	C3H8O3	1,2,3-Propanetriol	glycerin
1346	C3H8O2S	(Methylsulfonyl)ethane	c594434
1347	C4H9NO	Butanamide	c541355
1348	C4H9NO	Propanamide, 2-methyl-	c563837
1349	C5H10O	2-Butanone, 3-methyl-	c563804
1350	C5H10O	2H-Pyran, tetrahydro-	c142687
1351	C5H10O	2-methylbutyraldehyde	2meba
1352	C5H10O	2-Pentanone	mpk
1353	C5H10O	Cyclopentanol	c96413
1354	C5H10O	Oxetane, 3,3-dimethyl-	c6921353
1355	C5H10O	Pentanal	pal
1356	C5H10S	2H-Thiopyran, tetrahydro-	c1613510
1357	C5H10S	3-Ethylthio-1-propene	c5296628
1358	C5H10S	Cyclopentanethiol	c1679078
1359	C5H10S	Thiophene, tetrahydro-2-methyl-	c1795091
1360	C5H10S	Thiophene, tetrahydro-3-methyl-	c4740005
1361	C4H10O2	1,1-Dimethoxyethane	c534156
1362	C4H10O2	1,3-Butanediol	budiol13
1363	C4H10O2	1,4-Butanediol	budiol14
1364	C4H10O2	Ethane, 1,2-dimethoxy-	c110714
1365	C4H10OS	Diethyl sulfoxide	c70291
1366	C4H10S2	1,4-Butanedithiol	budisl14
1367	C4H11NO	Diethylhydroxylamine	c3710847
1368	C5H12O	1-Butanol, 2-methyl-	c137326
1369	C5H12O	1-Butanol, 3-methyl-	c123513
1370	C5H12O	1-Pentanol	pentanol1
1371	C5H12O	2-Butanol, 3-methyl-	c598754
1372	C5H12O	2-Pentanol	peol2
1373	C5H12O	3-Pentanol	pentan3ol
1374	C5H12O	Butane, 1-methoxy-	meobu
1375	C5H12O	Propane, 1-ethoxy-	proet
1376	C5H12O	Propane, 2-methoxy-2-methyl-	c1634044
1377	C5H12S	1-Butanethiol, 2-methyl-	c1878188
1378	C5H12S	1-Butanethiol, 3-methyl-	c541311
1379	C5H12S	1-Pentanethiol	c110667
1380	C5H12S	1-Propanethiol, 2,2-dimethyl-	c1679089
1381	C5H12S	2-Butanethiol, 2-methyl-	c1679090
1382	C5H12S	2-Butanethiol, 3-methyl-	c2084186
1383	C5H12S	Butane, 1-(methylthio)-	c628295
1384	C5H12S	Ethyl propyl sulfide	c4110503
1385	C5H12S	Propane, 2-(ethylthio)-	c5145993
1386	C5H12S	Propane, 2-methyl-2-(methylthio)-	c6163640
1387	ClCOClCO	Oxalyl chloride	oxcl
1388	CF3CN	Acetonitrile, trifluoro-	cf3cn
1389	CF3CN+	Acetonitrile, trifluoro- cation	cf3cn+
1390	B2F4	Diboron tetrafluoride	b2f4
1391	B2Cl4	Diboron tetrachloride	b2cl4
1392	C2F4	Tetrafluoroethylene	c2f4
1393	C2F4+	Tetrafluoroethylene cation	c2f4+
1394	CF2CCl2	difluorodichloroethylene	cf2ccl2
1395	CFClCClF	trans-1,2-dichloro-1,2-difluoroethylene	cfclcclf
1396	CFClCFCl	cis-1,2-dichloro-1,2-difluoroethylene	cfclcfcl
1397	C2FCl3	fluorotrichloroethene	c2fcl3
1398	C2Cl4	Tetrachloroethylene	c2cl4
1399	CF3OF	Trifluoromethylhypofluorite	cf3of
1400	SOF4	Sulfur tetrafluoride oxide	sof4
1401	AsF5	Arsenic pentafluoride	asf5
1402	PCl5	Phosphorus pentachloride	pcl5
1403	SF5	Sulfur pentafluoride	sf5
1404	SF5+	pentafluoro sulfur cation	sf5+
1405	SbCl5	Antimony pentachloride	sbcl5
1406	BrF5	bromine pentafluoride	brf5
1407	ClF5	chlorinepentafluoride	clf5
1408	IF5	pentafluoroiodine	if5
1409	CF3CHO	trifluoroacetaldehyde	cf3cho
1410	CCl3CHO	trichloroacetaldehyde	ccl3cho
1411	CHFClCHClF	ethane, 1,2-dichloro-1,2-difluoro-	chfclchclf
1412	CF3CH2F	1,1,1,2-tetrafluoroethane	cf3ch2f
1413	CHF2CHF2	1,1,2,2-tetrafluoroethane	chf2chf2
1414	CF3CH2Cl	2,2,2-Trifluoroethyl chloride	cf3ch2cl
1415	CHFClCHFCl	1,2-dichloro-1,2-difluoroethane RR	chfclchfcl
1416	CH2ClCCl3	1,1,1,2-tetrachloroethane	ch2clccl3
1417	CHCl2CHF2	1,1-dichloro-2,2-difluoroethane	c2h2cl2f2
1418	CF3COOH	trifluoroacetic acid	cf3cooh
1419	C4H3ClO	Furan, 2-chloro	fur2cl
1420	C4H3ClO	Furan,3-chloro	fur3cl
1421	C3H5ClO2	Carbonochloridic acid, ethyl ester	c541413
1422	C3H5Cl3	Propane, 1,2,3-trichloro-	prcl135
1423	C4H8Cl2	1,4-Dichlorobutane	c110565
1424	C4H8Cl2	Butane, 1,2-dichloro-	c616217
1425	C4H8Cl2	Butane, 1,3-dichloro-	c1190223
1426	C4H8Cl2	Butane, 2,3-dichloro-, (r*,r*)-(.+/-.)-	c2211678
1427	C4H8Cl2	Butane, 2,3-dichloro-, (r*,s*)-	c4028562
1428	C4H9ClO	1-Chloro-2-ethoxyethane	c628342
1429	C5H11Cl	Pentane, 1-chloro-	pencl1
1430	C4H8O2	Butanoic acid	bua
1431	C6H5CH2	benzyl radical	benzyl
1432	C6H5CH3	toluene	toluene
1433	C7H8	cycloheptatriene	cht
1434	C7H8	Norbornadiene	norbor
1435	C7H8	Quadricyclane	qucy
1436	C7H12	Norbornane	nor
1437	C7H14	cycloheptane	c7h14
1438	C7H16	2-methylhexane	2mhex
1439	C7H16	3-methylhexane	hex3m
1440	C7H16	heptane	heptane
1441	C6H7N	2-Methylpyridine	mp
1442	C6H5NH2	aniline	aniline
1443	C6H13N	2-Methylpiperidine	pip2m
1444	C6H13N	cyclohexanamine	cham
1445	C6H15N	triethylamine	tea
1446	N2O5	Dinitrogen pentoxide	n2o5
1447	C4H2O3	Maleic Anhydride	malan
1448	C5H4O2	4-Cyclopentene-1,3-dione	cpdio
1449	C6H5O	phenoxy radical	phenoxy
1450	C5H5NO	2(1H)-Pyridinone	c72762006
1451	C5H5NO	2(3H)-Pyridinone	c9000048
1452	C5H5NO	2(5H)-Pyridinone	c9000037
1453	C5H5NO	2-Pyridinol	c109104
1454	C5H5NO	3(2H)-Pyridinone	c9000004
1455	C5H5NO	3(4H)-Pyridinone	c9000026
1456	C5H5NO	3(6H)-Pyridinone	c9000015
1457	C5H5NO	3-Pyridinol	c109002
1458	C5H5NO	4(1H)-Pryidinone	c9000060
1459	C5H5NO	4(3H)-Pryidinone	c9000059
1460	C5H5NO	4-Pyridinol	c626642
1461	C6H5OH	phenol	phenol
1462	C6H6O	2,4-Cyclohexadienone	c24599573
1463	C6H6O	2,5-Cyclohexadienone	c5664335
1464	C6H5SH	Benzenethiol	phsh
1465	HO2CCHNH2CH2OH	Serine	serine
1466	C5H8O2	Acetylacetone	acac
1467	C4H8O2S	Sulfolane	sulfolane
1468	C7H10	Norbornene	norbornene
1469	CH(C2H3)3	trivinyl methane	tvm
1470	C6H10O	cyclohexanone	chexo
1471	C6H12O	hexanal	c6h12o
1472	C3H7OC3H7	di-n-propyl ether	propr
1473	CF3COO-	trifluoro acetate anion	cf3coo-
1474	CF3COF	trifluoroacetyl fluoride	cf3cof
1475	CF3COCl	trifluoroacetyl chloride	cf3cocl
1476	PF6	Hexafluorophosphate neutral	pf6
1477	PF6-	Hexafluorophosphate ion	pf6-
1478	SeF6	Selenium hexafluoride	sef6
1479	SF5Cl	sulfur chloropentafluoride	sf5cl
1480	CF3CHF2	pentafluoroethane	cf3chf2
1481	CF3CHFCl	1,1,1,2-tetrafluorochloroethane	cf3chfcl
1482	CF3CHCl2	1,1-Dichloro-2,2,2-trifluoroethane	cf3chcl2
1483	CHCl2CClF2	Ethane, 1,2,2-trichloro-1,1-difluoro-	chcl2cclf2
1484	CCl3CHCl2	pentachloroethane	ccl3chcl2
1485	C6H5F	Fluorobenzene	bzf
1486	C6H5Cl	chlorobenzene	bzcl
1487	C6H5Br	bromobenzene	bzbr
1488	C8H6	Calicene	calicene
1489	C6H5CCH	phenylacetylene	phac
1490	C8H6	benzocyclobutadiene	bcbd
1491	C8H6	Pentalene	pentalene
1492	C6H5CHCH2	Styrene	styrene
1493	C8H8	cyclooctatetraene	cot
1494	C6H5CH2CH3	Ethylbenzene	etbz
1495	CH3C6H4CH3	meta-xylene	mxylene
1496	CH3C6H4CH3	paraxylene	pxylene
1497	C8H14	Bicyclo[2.2.2]octane	bico222
1498	C8H16	cyclooctane	cyclooct
1499	(CH3)3CC(CH3)3	tetramethylbutane	tmb
1500	C8H18	Octane	c8h18
1501	C6H5CN	phenyl cyanide	phcn
1502	C6H12N2	Triethylenediamine	ted
1503	C4O4--	squarate dianion	c4o4--
1504	S8	Octasulfur	s8
1505	C6H4O2	parabenzoquinone	pbq
1506	C4H4N2O2	Uracil	uracil
1507	C6H5OCH3	Anisole	anisole
1508	C5H9NO2	Proline	proline
1509	C6H12O2	Methyl pivalate	c598981
1510	C6H12O2	Hexanoic acid	hexa
1511	C4F4	tetrafluorcyclobutadiene	c4f4
1512	Al2Cl6	Aluminum, di-μ-chlorotetrachlorodi-	al2cl6
1513	CF3CF2Cl	pentafluorochloroethane	cf3cf2cl
1514	CF2ClCF2Cl	1,2-Dichloro-1,1,2,2-tetrafluoroethane	cf2clcf2cl
1515	CF3CFCl2	1,1-Dichlorotetrafluoroethane	cf3cfcl2
1516	CF2ClCFCl2	Ethane, 1,1,2-trichloro-1,2,2-trifluoro-	cf2clcfcl2
1517	CF3CCl3	1,1,1-trifluoro-2,2,2-trichloroethane	cf3ccl3
1518	C2F6	hexafluoroethane	c2f6
1519	C2Cl6	hexachloroethane	c2cl6
1520	IF7	Iodine heptafluoride	if7
1521	C6H4F2	metadifluorobenzene	mdfb
1522	C6H4F2	orthodifluorobenzene	odfb
1523	C6H4Cl2	1,2-dichlorobenzene	dcb12
1524	C6H4Cl2	1,3-dichlorobenzene	dcb13
1525	C9H8	Indene	indene
1526	C9H8	spiro[4.4]nona-1,3,6,8-tetraene	snt
1527	C9H12	n-propyl benzene	prbz
1528	C9H20	Nonane	nonane
1529	C(CN)4	tetracyanomethane	c5n4
1530	C5H4N4	purine	purine
1531	C8H7N	Indole	indole
1532	C3H3N3O3	cyanuric acid	cyanuric
1533	C6H5NO2	Nitrobenzene	c6h5no2
1534	C6H5COOH	benzoic acid	benzo
1535	CH3COC6H5	acetophenone	acph
1536	C3Cl3N3	1,3,5-Triazine, 2,4,6-trichloro-	c3cl3n3
1537	C6H3F3	Benzene trifluoride 123	bzf3a
1538	C10H8	Azulene	azu
1539	C10H8	naphthalene	naph
1540	C10H16	adamantane	adamantane
1541	C6N4	Tetracyanoethylene	tcne
1542	C6N4-	tetracyanoethylene anion	tcne-
1543	C10H22	Decane	decane
1544	C4F6	perfluorobutadiene	c4f6
1545	SF5CF3	Sulfur, pentafluoro(trifluoromethyl)-	sf5cf3
1546	C3F8	perfluoropropane	c3f8
1547	Fe(CO)5	Iron pentacarbonyl	ipc
1548	Fe(C5H5)2	ferrocene	fecp2
1549	B12H12--	Dodecahydrododecaborate(2-)	b12h12--
1550	C12H8	Acenaphthylene	acenaph
1551	C12H8	biphenylene	biph
1552	C12H10	biphenyl	biphenyl
1553	C12H10	Heptalene	heptalene
1554	C6H12O6	Inositol	inositol
1555	C6F6	hexafluorobenzene	c6f6
1556	S2F10	disulphur decafluoride	s2f10
1557	C14H10	Anthracene	anth
1558	C14H10	Phenanthrene	phenanthrene
1559	C12H10N2	azobenzene	azobenzene
1560	C6H5COC6H5	benzophenone	benzophenone
1561	C16H10	Pyrene	pyrene
1562	C18H12	Tetracene	tetracene
1563	C19H16	Triphenylmethane	tpm
1564	C24H12	Coronene	coronene
1565	C60	Buckminsterfullerene	c60