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
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IX	Feedback
X	Older CCCBDB versions
XII	Geometries
XIII	Vibrations
XIV	Reaction data
XV	Entropy data
XVI	Bibliographic data
XVII	Ion data
XVIII	Bad calculations
XIX	Index of properties
XX	H-bond dimers
XXI	Oddities

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

List of which calculations are completed at MP2FC// HF/6-31G* /cc-pVDZ

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count	Species	Name	State	Conformation
1	D	Deuterium atom	1S	Kh
2	H	Hydrogen atom	1S	Kh
3	H-	Hydrogen atom anion	2S	Kh
4	H+	Hydrogen atom cation		Kh
5	D2	Deuterium diatomic	1Σg	D∞h
6	H2	Hydrogen diatomic	1Σg	D∞h
7	He	Helium atom	1S	Kh
8	He-	Helium atom anion	2S	Kh
9	He+	Helium atom cation	2S	Kh
10	Li	Lithium atom	2S	Kh
11	Li-	Lithium atom anion	1S	Kh
12	Li+	Lithium atom cation	1S	Kh
13	Na-	Sodium atom anion	1S	Kh
14	Na+	Sodium atom cation	1S	Kh
15	Be	Beryllium atom	1S	Kh
16	Be-	Beryllium atom anion	2P	Kh
17	Be+	Beryllium atom cation	2S	Kh
18	Mg-	Magnesium atom anion	2P	Kh
19	Mg+	Magnesium atom cation	2S	Kh
20	Ca	Calcium atom	1S	Kh
21	B	Boron atom	2P	Kh
22	B-	Boron atom anion	3P	Kh
23	B+	Boron atom cation	1S	Kh
24	Al	Aluminum atom	2P	Kh
25	Al-	Aluminum atom anion	3P	Kh
26	Al+	Aluminum atom cation	1S	Kh
27	BH	Boron monohydride	1Σ	C∞v
28	AlH	aluminum monohydride	1Σ	C∞v
29	BH2	boron dihydride	2A1	C2v
30	AlH2	aluminum dihydride	2A1	C2v
31	BH3	boron trihydride	1A1'	D3h
32	AlH3	aluminum trihydride	1A1'	D3h
33	C	Carbon atom	3P0	Kh
34	C-	Carbon atom anion	4S	Kh
35	C+	Carbon atom cation	2P	Kh
36	Si	Silicon atom	3P	Kh
37	Si-	Silicon atom anion	4S	Kh
38	Si+	Silicon atom cation	2P	Kh
39	CH	Methylidyne	2Π1/2	C∞v
40	SiH	Silylidyne	2Π	C∞v
41	CH2	Methylene	3B1	C2v
42	SiH2	silicon dihydride	1A1	C2v
43	CH3	Methyl radical	2A1	D3h
44	SiH3	Silyl radical	2A1	C3v
45	CH4	Methane	1A1	Td
46	SiH4	Silane	1A1	Td
47	N-	Nitrogen atom anion	3S	Kh
48	N+	Nitrogen atom cation	3P	Kh
49	P	Phosphorus atom	4S	Kh
50	P-	Phosphorus atom anion	3P	Kh
51	P+	Phosphorus atom cation	3P	Kh
52	As	Arsenic atomic	4S	Kh
53	NH	Imidogen	3Σ-	C∞v
54	PH	phosphorus monohydride	3Σ-	C∞v
55	ND2	Amidogen-d2	2B1	C2v
56	NH2	Amino radical	2B1	C2v
57	PH2	Phosphino radical	2B1	C2v
58	ND3	Ammonia-d3	1A1	C3v
59	NH3	Ammonia	1A1	C3v
60	PH3	Phosphine	1A1	C3v
61	O	Oxygen atom	3S	Kh
62	O-	Oxygen atom anion	2P	Kh
63	O+	Oxygen atom cation	4S	Kh
64	S	Sulfur atom	3P	Kh
65	S-	Sulfur atom anion	2P	Kh
66	S+	Sulfur atom cation	4S	Kh
67	Se	Selenium atom	3P	Kh
68	Se-	Selenium atom anion	2P	Kh
69	Se+	Selenium atom cation	4S	Kh
70	DO	Hydroxyl-d	2Π	C∞v
71	OH	Hydroxyl radical	2Π	C∞v
72	DS	Mercapto-d	2Π	C∞v
73	HS	Mercapto radical	2Π	C∞v
74	D2O	Deuterium oxide	1A1	C2v
75	H2O	Water	1A1	C2v
76	HDO	Water-d1	1A1	C2v
77	D2S	Hydrogen sulfide-d2	1A1	C2v
78	H2S	Hydrogen sulfide	1A1	C2v
79	F	Fluorine atom	2P	Kh
80	F-	Fluorine atom anion	1S	Kh
81	F+	Fluorine atom cation	3S	Kh
82	Cl	Chlorine atom	2P	Kh
83	Cl-	Chlorine atom anion	1S	Kh
84	Cl+	Chlorine atom cation	3P	Kh
85	Br	Bromine atom	2P	Kh
86	Br-	Bromine atom anion	1S	Kh
87	Br+	Bromine atom cation	3P	Kh
88	DF	Hydrofluoric acid-d	1Σ	C∞v
89	HF	Hydrogen fluoride	1Σ	C∞v
90	DCl	Hydrochloric acid-d	1Σ	C∞v
91	HCl	Hydrogen chloride	1Σ	C∞v
92	Ne	Neon atom	1S	Kh
93	Ne-	Neon atom anion	2S	Kh
94	Ne+	Neon atom cation	2P	Kh
95	Ar	Argon atom	1S	Kh
96	Ar-	Argon atom anion	2S	Kh
97	Ar+	Argon atom cation	2P	Kh
98	Al2	Aluminum diatomic	3Σg	D∞h
99	B2H6	Diborane	1Ag	D2h
100	C2	Carbon diatomic	1Σg+	D∞h
101	Si2	Silicon diatomic	3Σg	D∞h
102	C2H	Ethynyl radical	2Σ	C∞v
103	C2H2	Acetylene	1Σg	D∞h
104	C2H3	vinyl	2A'	Cs
105	C2H4	Ethylene	1Ag	D2h
106	C2H5	Ethyl radical	2A'	Cs
107	C2H6	Ethane	1A1g	D3d
108	CH3SiH3	methyl silane	1A1	C3
109	Si2H6	disilane	1Eu	D3d
110	CN	Cyano radical	2Σ	C∞v
111	CP	Carbon monophosphide	2Σ	C∞v
112	SiN	Silicon nitride	2Σ	C∞v
113	N2	Nitrogen diatomic	1Σg	D∞h
114	PN	Phosphorus mononitride	1Σ	C∞v
115	P2	Phosphorus diatomic	1Σg	D∞h
116	HCN	Hydrogen cyanide	1Σ	C∞v
117	HCP	Phosphaethyne	1Σ	C∞v
118	HPO	Hydrogen phosphorus oxide	1A'	Cs
119	CH2NH	Methanimine	1A'	Cs
120	N2H4	Hydrazine	1A	C2
121	P2H4	Diphosphine	1A	C2
122	CH3NH2	methyl amine	1A'	Cs
123	CH3PH2	Methyl phosphine	1A'	Cs
124	BO	boron monoxide	2Σ	C∞v
125	AlO	Aluminum monoxide	2Σ	C∞v
126	BS	boron sulfide	2Σ	C∞v
127	AlS	Aluminum sulfide	2Σ	C∞v
128	CO	Carbon monoxide	1Σ	C∞v
129	CS	carbon monosulfide	1Σ	C∞v
130	SiO	Silicon monoxide	1Σ	C∞v
131	SiS	silicon monosulfide	1Σ	C∞v
132	NO	Nitric oxide	2Π	C∞v
133	NS	Mononitrogen monosulfide	2Π	C∞v
134	PO	Phosphorus monoxide	2Π	C∞v
135	PS	phosphorus sulfide	2Σ	C∞v
136	O2	Oxygen diatomic	3Σg	D∞h
137	SO	Sulfur monoxide	3Σ	C∞v
138	S2	Sulfur diatomic	3Σg	D∞h
139	HBO	Boron hydride oxide	1Σ	C∞v
140	HBS	hydrogen boron sulfide	1Σ	C∞v
141	HCO	Formyl radical	2A'	Cs
142	HNO	Nitrosyl hydride	1A'	Cs
143	HO2	Hydroperoxy radical	2A"	Cs
144	H2CO	Formaldehyde	1A1	C2v
145	H2CS	Thioformaldehyde	1A1	C2v
146	H2O2	Hydrogen peroxide	1A	C2
147	H2S2	Disulfane	1A	C2
148	CH2OH	Hydroxymethyl radical	2A	C1
149	CH3O	Methoxy radical	2A'	C1
150	CH3S	thiomethoxy	2A'	C3v
151	NH2OH	hydroxylamine	1A'	Cs
152	CH3OH	Methyl alcohol	1A'	Cs
153	CH3SH	Methanethiol	1A'	Cs
154	AlF	Aluminum monofluoride	1Σ+	C∞v
155	BCl	boron monochloride	1Σ	C∞v
156	CF	Fluoromethylidyne	2Π	C∞v
157	CCl	carbon monochloride	2Π	C∞v
158	SiF	silicon monofluoride	2Π	C∞v
159	SiCl	Clorosilylidyne	2Π	C∞v
160	NF	nitrogen fluoride	3Σ	C∞v
161	PF	phosphorus monofluoride	3Σ	C∞v
162	PCl	phosphorus chloride	3Σ	C∞v
163	FO	Oxygen monofluoride	2Π	C∞v
164	ClO	Monochlorine monoxide	2Π	C∞v
165	SF	Monosulfur monofluoride	2Π	C∞v
166	SCl	sulfur monochloride	2Π	C∞v
167	F2	Fluorine diatomic	1Σg	D∞h
168	ClF	Chlorine monofluoride	1Σ+	C∞v
169	Cl2	Chlorine diatomic	1Σg	D∞h
170	HCF	Fluoromethylene	1A'	Cs
171	HOF	Hypofluorous acid	1A'	Cs
172	DOCl	Hypochlorous acid-d	1A'	Cs
173	HOCl	hypochlorous acid	1A'	Cs
174	H2F2	Hydrogen fluoride dimer	1Ag	Cs
175	CH3F	Methyl fluoride	1A1	C3v
176	CH3Cl	Methyl chloride	1A1	C3v
177	SiH3F	monofluorosilane	1A1	C3v
178	SiH3Cl	chlorosilane	1A1	C1
179	C3	carbon trimer	1Σg	D∞h
180	C3H3	Propargyl radical	2B1	Cs
181	CH2CCH2	allene	1A1	D2d
182	CH3CCH	propyne	1A'	C3v
183	C3H5	Allyl radical	2A2	C2v
184	C3H6	Cyclopropane	1A1'	D3h
185	CH2CHCH3	Propene	1A'	Cs
186	C3H7	n-Propyl radical	2A"	C1
187	CH3CHCH3	Isopropyl radical	2A	C2
188	C3H8	Propane	1A1	C2v
189	CH3CN	Acetonitrile	1A1	C3v
190	C2H5N	Aziridine	1A'	C1
191	CH3CH2NH2	Ethylamine	1A'	Cs
192	CH3NHCH3	Dimethylamine	1A'	Cs
193	BO2	Boron dioxide	2A'	D∞h
194	N2O	Nitrous oxide	1Σ	C∞v
195	CO2	Carbon dioxide	1Σg	D∞h
196	OCS	Carbonyl sulfide	1Σ	C∞v
197	SiO2	silicon dioxide	1Σg	D∞h
198	CS2	Carbon disulfide	1Σg	D∞h
199	NO2	Nitrogen dioxide	2A1	C2v
200	PO2	Phosphorus dioxide	2A1	C2v
201	O3	Ozone	1A1	Cs
202	SO2	Sulfur dioxide	1A1	C2v
203	SSO	Disulfur monoxide	1A'	Cs
204	HNCO	Isocyanic acid	1A'	Cs
205	HNO2	Nitrous acid	1A'	Cs
206	CH2CO	Ketene	1A1	C2v
207	HCOOH	Formic acid	1A'	Cs
208	CH3CO	Acetyl radical	2A'	Cs
209	CHONH2	formamide	1A'	Planar
210	C2H4O	Ethylene oxide	1A1	C2v
211	CH3CHO	Acetaldehyde	1A'	Cs
212	C2H4S	Thiirane	1A1	C2v
213	CH3CHS	Thioacetaldehyde	1A'	C1
214	CH3CH2OH	Ethanol	1A'	Cs
215	CH3OCH3	Dimethyl ether	1A1	C2v
216	CH3CH2SH	ethanethiol	1A'	Cs
217	CH3SCH3	Dimethyl sulfide	1A1	C2v
218	ClCN	chlorocyanogen	1Σ	C∞v
219	FNO	Nitrosyl fluoride	1A'	Cs
220	ClNO	Nitrosyl chloride	1A'	Cs
221	CF2	Difluoromethylene	1A1	D∞h
222	CCl2	dichloromethylene	1A1	C2v
223	SiCl2	Dichlorosilylene	1A1	C2v
224	FOO	Dioxygen monofluoride radical	2A"	Cs
225	ClOO	chloroperoxy radical	2A"	Cs
226	OClO	Chlorine dioxide	2B1	D∞h
227	ClS2	Sulfur chloride	2A"	Cs
228	NF2	Difluoroamino radical	2B1	C2v
229	F2O	Difluorine monoxide	1A1	C2v
230	Cl2O	Dichlorine monoxide	1A1	C2v
231	BHF2	Difluoroborane	1A1	C2v
232	BHCl2	Borane, dichloro-	1A1	C2v
233	CH2F2	Methane, difluoro-	1A1	C2v
234	CH2Cl2	Methylene chloride	1A1	C2v
235	CH2CHF	Ethene, fluoro-	1A'	Cs
236	C2H3Cl	Ethene, chloro-	1A'	Cs
237	CH3CH2Cl	Ethyl chloride	1A'	Cs
238	C4H6	1-Methylcyclopropene	1A	C1
239	C4H6	Cyclobutene	1A1	C2v
240	C4H6	Methylenecyclopropane	1A1	C2v
241	CH2CCHCH3	1,2-Butadiene	1A'	C1
242	CH2CHCHCH2	1,3-Butadiene	1Ag	C2h
243	CH3CCCH3	2-Butyne	1A1'	D3h
244	CH2C(CH3)CH3	1-Propene, 2-methyl-	1A1	C2v
245	CH3CHCHCH3	2-Butene, (E)-	1Ag	C2h
246	CH3CHCHCH3	2-Butene, (Z)-	1A1	C2v
247	C(CH3)3	Tert-butyl radical	2A"	C3v
248	CH2CH(CH3)2	Isobutyl radical	2A'	C1
249	CH3CHCH2CH3	2-Butyl radical	1A	C1
250	CH3CH(CH3)CH3	Isobutane	1A1	C3v
251	CH3CH2CH2CH3	Butane	1Ag	Anti
252	C2N2	Cyanogen	1Σg	D∞h
253	P4	Phosphorus tetramer	1A1	Td
254	C3H3N	acrylonitrile	1A'	Cs
255	C3H7N	Cyclopropylamine	1A'	C1
256	C4H8	cyclobutane	1A1	D2d
257	C2H8N2	Ethylenediamine	1Ag	C2h
258	CH3CH(NH2)CH3	2-Propanamine	1A'	Cs
259	N(CH3)3	Trimethylamine	1A1	C3v
260	NH2CH2CH2CH3	1-Propanamine	1A'	Cs
261	B2O2	Diboron dioxide	1Σg	D∞h
262	SO3	Sulfur trioxide	1A1'	D3h
263	HNO3	Nitric acid	1A'	Cs
264	C2H2O2	Ethanedial	1Ag	C2h
265	CH3NO2	Methane, nitro-	1A'	Cs
266	CH3ONO	Methyl nitrite	1A'	C1
267	C3H4O	Cyclopropanone	1A1	C2v
268	NH2CONH2	Urea	1A	C2
269	NH2CSNH2	Thiourea	1A	C2
270	CH3COOH	Acetic acid	1A'	Cs
271	CH3OCHO	methyl formate	1A'	Cs
272	CH3CHNOH	Acetaldoxime	1A'	CS trans
273	CH3CONH2	Acetamide	1A'	C1
274	C3H6O	Propylene oxide	1A	C1
275	CH3CH2CHO	Propanal	1A'	Cs
276	CH3COCH3	Acetone	1A1	C2v
277	C3H6S	Thietane	1A'	Cs
278	C3H6S	Thiirane, methyl-	1A	C1
279	C2H6O2	1,2-Ethanediol	1Ag	C2h
280	CH3SOCH3	Dimethyl sulfoxide	1A'	Cs
281	CH2SHCH2SH	1,2-Ethanedithiol	1Ag	C2h
282	CH3SSCH3	Disulfide, dimethyl	1A	C2
283	CH3CHOHCH3	Isopropyl alcohol	1A	C1
284	CH3OC2H5	Ethane, methoxy-	1A'	Cs
285	C3H7SH	1-Propanethiol	1A'	Cs
286	CH3CHSHCH3	2-Propanethiol	1A'	Cs
287	CH3SCH2CH3	Ethane, (methylthio)-	1A'	Cs
288	ClNO2	Nitryl chloride	1A1	C2v
289	N2F2	(Z)-Difluorodiazene	1A1	C2v
290	N2F2	Dinitrogen difluoride, (E)-	1Ag	C2h
291	CF2O	Carbonic difluoride	1A1	C2v
292	CCl2O	Phosgene	1A1	C2v
293	BF3	Borane, trifluoro-	1A'	D3h
294	AlF3	Aluminum trifluoride	1A1'	D3h
295	AlF2Cl	Aluminum chloride difluoride	1A1	C2v
296	AlFCl2	Aluminum dichloride fluoride	1A1	C2v
297	BCl3	Borane, trichloro-	1A1'	D3h
298	AlCl3	Aluminum trichloride	1A1'	D3h
299	CF3	Trifluoromethyl radical	2A1	C3v
300	CCl3	Trichloromethyl radical	2A1	C3
301	NF3	Nitrogen trifluoride	1A1	C3v
302	PF3	Phosphorus trifluoride	1A1	C3v
303	PCl3	Phosphorus trichloride	1A1	C3v
304	CHF3	Methane, trifluoro-	1A1	C3v
305	CHCl3	Chloroform	1A1	C3v
306	SiHCl3	Trichlorosilane	1A1	C3v
307	CH2CF2	Ethene, 1,1-difluoro-	1A1	C2v
308	CH2CCl2	Ethene, 1,1-dichloro-	1A1	C2v
309	CHClCHCl	Ethene, 1,2-dichloro-, (E)-	1Ag	C2h
310	CHClCHCl	Ethene, 1,2-dichloro-, (Z)-	1A1	C2v
311	CH3COF	Acetyl fluoride	1A'	NULL
312	CH3COCl	Acetyl Chloride	1A'	Cs
313	CH3CHF2	Ethane, 1,1-difluoro-	1A'	Cs
314	CH3CHFCl	Ethane, 1-chloro-1-fluoro-	1A	C1
315	CH2ClCH2Cl	Ethane, 1,2-dichloro-	1Ag	C2h
316	CH3CHCl2	Ethane, 1,1-dichloro-	1A'	Cs
317	C5H6	1,3-Cyclopentadiene	1A1	C2v
318	C5H6	1-Buten-3-yne, 2-methyl-	1A'	Cs
319	C5H6	3-Penten-1-yne, (E)-	1A'	Cs
320	C5H6	3-Penten-1-yne, (Z)-	1A'	Cs
321	C5H6	Bicyclo[2.1.0]pent-2-ene	1A'	Cs
322	C5H6	Cyclopropylacetylene	1A'	C1
323	C5H8	1,2-Butadiene, 3-methyl-	1A1	C2v
324	C5H8	1,2-Pentadiene	1A'	C1
325	C5H8	1,3-Butadiene, 2-methyl-	1A'	Cs
326	C5H8	1,3-Pentadiene, (E)-	1A'	C1
327	C5H8	1,3-Pentadiene, (Z)-	1A'	Cs
328	C5H8	1,4-Pentadiene	1A	C2
329	C5H8	2,3-Pentadiene	1A	C1
330	C5H8	Cyclobutane, methylene-	1A'	Cs
331	C5H8	Cyclopentene	1A'	Cs
332	C5H10	1-Butene, 2-methyl-	1A	C1
333	C5H10	2-Butene, 2-methyl-	1A'	Cs
334	C5H10	2-Pentene, (E)-	1A'	Cs
335	C5H10	2-Pentene, (Z)-	1A	C1
336	C5H10	Cyclopentane	1A	C1
337	C5H10	Cyclopropane, 1,1-dimethyl-	1A1	C1
338	C5H11	2-Methylbut-2-yl radical	1A	C1
339	C5H12	Butane, 2-methyl-	1A	C1
340	C5H12	Pentane	1A1	C2v
341	C5H12	Propane, 2,2-dimethyl-	1A1	Td
342	N2O3	Dinitrogen trioxide	1A'	Cs
343	C3H2N2	Malononitrile	1A1	Cs
344	C3H4N2	1H-Imidazole	1A'	Cs
345	C3H4N2	1H-Pyrazole	1A'	Cs
346	C4H5N	(E)-2-Butenenitrile	1A'	Cs
347	C4H5N	(Z)-2-Butenenitrile	1A'	Cs
348	C4H5N	Cyclopropanecarbonitrile	1A'	Cs
349	C4H5N	Pyrrole	1A1	C2v
350	C3H6N2	3-Aminopropionitrile	1A'	Cs
351	C5H8	Bicyclo[2.1.0]pentane	1A'	Cs
352	C5H8	Spiropentane	1A1	D2d
353	C4H9N	Cyclobutylamine	1A'	Cs
354	C4H9N	Pyrrolidine	1A'	Cs
355	C3H10N2	1,2-Diaminopropane	1A	C1
356	C(CH3)3NH2	2-Propanamine, 2-methyl-	1A	C1
357	C(NH2)H2C(CH3)HCH3	1-Propanamine, 2-methyl-	1A	C1
358	CH3C(NH2)HCH2CH3	2-Butanamine	1A	C1
359	C3O2	Carbon suboxide	1ΣG	D∞h
360	H2SO4	Sulfuric acid	1A	C1
361	C3H3NO	Isoxazole	1A'	Cs
362	CH3NO3	Methyl nitrate	1A'	Cs
363	C4H4O	Furan	1A1	C2
364	C4H4S	Thiophene	1A1	C2v
365	C3H4O2	β–Propiolactone	1A'	Cs
366	C3H4O2	2-Propenoic acid	1A'	Cs
367	CH2CHCONH2	Acrylamide	1A	Cs
368	CH3OCH2CN	Methoxyacetonitrile	1A'	Cs
369	CH5N3S	Hydrazinecarbothioamide	1A	C1
370	C4H6O	Cyclobutanone	1A1	C2v
371	C4H6O	Furan, 2,3-dihydro-	1A	C1
372	CH2CHOCHCH2	Vinyl ether	1A1	C2v
373	CHOCHCHCH3	2-Butenal	1A'	Cs
374	C4H6S	Thiophene, 2,3-dihydro-	1A	C1
375	C4H6S	Thiophene, 2,5-dihydro-	1A1	C2v
376	CH2CHSCHCH2	Divinyl sulfide	1A	C2v
377	C2H6N2O	Urea, methyl-	1A	C1
378	C3H6O2	1,3-Dioxolane	1A	C2
379	CH3COOCH3	methyl acetate	1A'	Cs
380	C2H6O2S	Dimethyl sulfone	1A1	C2v
381	C3H7NO	Propanamide	1A'	C1
382	C2H3OC2H5	Ethene, ethoxy-	1A	C1
383	C4H8O	Cyclobutanol	1A'	C1
384	CH2C(CH3)OCH3	1-Propene, 2-methoxy-	1A	C1
385	CH3COCH2CH3	2-Butanone	1A'	Cs
386	CHOCH(CH3)CH3	Propanal, 2-methyl-	1A'	Cs
387	CHOCH2CH2CH3	Butanal	1A'	Cs
388	C4H8S	Thiophene, tetrahydro-	1A	C1
389	C3H8O2	Hydroperoxide, 1-methylethyl	1A	C1
390	C3H8O2	Methane, dimethoxy-	1A	C2
391	C3H8O2	Propylene glycol	1A	C1
392	C3H8S2	1,3-Propanedithiol	1A1	C1
393	C4H10O	2-Butanol, (.+/-.)-	1A	C1
394	C4H10O	Ethanol, 1,1-dimethyl-	1A'	Cs
395	C4H10O	Ethoxy ethane	1A1	C2v
396	C4H10O	Propane, 2-methoxy-	1A'	Cs
397	C(CH3)3SH	2-Propanethiol, 2-methyl-	1A'	Cs
398	C2H5SC2H5	Diethyl sulfide	1A1	C2v
399	CH2(SH)CH(CH3)CH3	1-Propanethiol, 2-methyl-	1A	C1
400	CH3C(SCH3)HCH3	Propane, 2-(methylthio)-	1A	C1
401	CH3CH(SH)CH2CH3	2-Butanethiol	1A	C1
402	FNO3	Fluorine nitrate	1A'	Cs
403	ClFO3	Perchloryl fluoride	1A1	Cs
404	SO2Cl2	Sulfuryl chloride	1A1	C2v
405	F3NO	Nitrogen trifluoride oxide	1A1	C3v
406	F3PO	Phosphoryl fluoride	1A1	C3v
407	Cl3PO	Phosphoryl chloride	1A1	C3v
408	CF4	Carbon tetrafluoride	1A1	Td
409	CF3Cl	Methane, chlorotrifluoro-	1A1	C3v
410	SiF4	Silicon tetrafluoride	1A1	Td
411	CF2Cl2	difluorodichloromethane	1A1	C2v
412	CFCl3	Trichloromonofluoromethane	1A1	C3v
413	CCl4	Carbon tetrachloride	1A1	Td
414	SiCl4	Silane, tetrachloro-	1A1	Td
415	CHClCCl2	Trichloroethylene	1A'	Cs
416	HSO3F	Fluorosulfonic acid	1A	C1
417	CH3CF3	Ethane, 1,1,1-trifluoro-	1A1	C3v
418	CH3CCl3	Ethane, 1,1,1-trichloro-	1A1	C3v
419	C3H5ClO	Oxirane, (chloromethyl)-	1A	C1
420	CH2ClCHClCH3	Propane, 1,2-dichloro-	1A	C1
421	CH3CCl2CH3	Propane, 2,2-dichloro-	1A1	C2v
422	CH2CClCH2CH3	1-Butene, 2-chloro-	1A'	Cs
423	CH2CHCH2CH2Cl	1-Butene, 4-chloro-	1A	C1
424	CH2CHCHClCH3	1-Butene, 3-chloro-	1A	C1
425	CH3CClCHCH3	2-Butene, 2-chloro-, (E)-	1A'	Cs
426	CH3CClCHCH3	2-Butene, 2-chloro-, (Z)-	1A'	Cs
427	CHClCHCH2CH3	(E)-1-Chloro-1-butene	1A	C1
428	CHClCHCH2CH3	(Z)-1-Chloro-1-butene	1A'	Cs
429	CH2ClCH2CH2CH3	Butane, 1-chloro-	1A'	Cs
430	CH3CCl(CH3)CH3	Propane, 2-chloro-2-methyl-	1A1	C3v
431	CH3CHClCH2CH3	Butane, 2-chloro-	1A	C1
432	C6H4	(E)-Hexa-1,5-diyne-3-ene	1Ag	Cs
433	C6H4	(Z)-Hexa-1,5-diyne-3-ene	1A1	C2v
434	C6H6	2,4-Hexadiyne	1A1'	D3h
435	C6H6	Benzene	1A1g	D6h
436	C6H8	(E)-hexa-1,3,5-triene	1Ag	Cs
437	C6H8	(E)-hexa-2,3,4-triene	1A'	C2h
438	C6H8	(Z)-hexa-1,3,5-triene	1A1	C2v
439	C6H8	(Z)-hexa-2,3,4-triene	1A1	C2v
440	C6H8	1,4-Cyclohexadiene	1Ag	C2v
441	C6H8	3-Methylenecyclopentene	1A	C1
442	C6H8	Bicyclo[2.1.1]hex-2-ene	1A1	C2v
443	C6H8	Bicyclo[2.2.0]hex-1(4)-ene	1Ag	D2h
444	C6H8	Bicyclo[3.1.0]hex-2-ene	1A	C1
445	C6H10	1,3-Hexadiene, (E)-	1A'	Cs
446	C6H10	1,3-Hexadiene, (Z)-	1A'	Cs
447	C6H10	1,4-Hexadiene, (E)-	1A	C1
448	C6H10	1,4-Hexadiene, (Z)-	1A	C1
449	C6H10	1-Butyne, 3,3-dimethyl-	1A1	C3v
450	C6H10	1-Hexyne	1A'	Cs
451	C6H10	2,4-Hexadiene, (E,E)-	1Ag	C2h
452	C6H10	2,4-Hexadiene, (Z,Z)-	1A'	Cs
453	C6H10	2-Hexyne	1A'	C1
454	C6H10	3-Hexyne	1A1	C2v
455	C6H10	Cyclopentene, 1-methyl-	1A	C1
456	C6H10	Cyclopentene, 3-methyl-	1A	C1
457	C6H10	Cyclopentene, 4-methyl-	1A	C1
458	C6H12	(E)-3-methylpent-2-ene	1A	C1
459	C6H12	(Z)-3-methylpent-2-ene	1A	C1
460	C6H12	3-methylenepentane	1A	C1
461	C6H12	Cyclohexane	1A1g	Chair
462	C6H12	Cyclopentane, methyl-	1A	C1
463	C6H12	Ethylcyclobutane	1A	C1
464	C6H12	hex-1-ene	1A'	Cs
465	C6H14	Butane, 2,2-dimethyl-	1A'	C1
466	C6H14	Butane, 2,3-dimethyl-	1Ag	C2h
467	C6H14	Hexane	1Ag	C2h
468	C6H14	Pentane, 2-methyl-	1A	C1
469	C6H14	Pentane, 3-methyl-	1A'	Cs
470	C4N2	2-Butynedinitrile	1Σg	D∞h
471	C3H3N3	1,3,5-Triazine	1A1'	D3h
472	CH3N5	5-Aminotetrazole	1A	C1
473	C4H4N2	1,3-Diazine	1A1	C2v
474	C4H4N2	Pyrazine	1Ag	D2h
475	C4H4N2	Pyridazine	1A1	C2v
476	C4H4N2	Succinonitrile	1Ag	C2h
477	C2H4N4	1H-Tetrazole, 1-methyl-	1A'	Cs
478	C2H4N4	1H-Tetrazole, 5-methyl-	1A'	C1
479	C2H4N4	2H-Tetrazole, 2-methyl-	1A	C1
480	C5H5N	Bicyclo[1.1.0]butane-1-carbonitrile	1A'	Cs
481	C5H5N	Pyridine	1A1	C2v
482	C6H6	Fulvene	1A1	C2v
483	C4H6N2	1H-Imidazole, 2-methyl-	1A'	Cs
484	C5H7N	(E)-2-Pentenenitrile	1A'	Cs
485	C5H7N	(E)-3-Pentenenitrile	1A	C1
486	C5H7N	(Z)-2-Pentenenitrile	1A	C1
487	C5H7N	1H-Pyrrole, 1-methyl-	1A	C1
488	C5H9N	1,2,3,6-Tetrahydropyridine	1A	C1
489	C5H9N	Butanenitrile, 2-methyl-	1A	C1
490	C5H9N	Pentanenitrile	1A'	Cs
491	C5H9N	Propanenitrile, 2,2-dimethyl-	1A1	C1
492	C5H11N	Cyclopentanamine	1A'	Cs
493	C5H11N	Piperidine	1A'	NH equatorial
494	C4H12N2	1,2-Butanediamine	1A	C1
495	C4H12N2	2-Methyl-1,2-propanediamine	1A'	C1
496	N2O4	Dinitrogen tetroxide	1Ag	D2d
497	C2H3NO3	Oxamic acid	1A'	H out
498	C4H4O2	2-Oxetanone, 4-methylene-	1A	C1
499	C2H4N2O2	Oxalamide	1Ag	C2h
500	C3H4O2S	2H-Thiete-1,1-dioxide	1A'	C1
501	C3H4S3	1,3-Dithiolane-2-thione	1A	C1
502	C4H5NO	3-Methylisoxazole	1A	C1
503	C4H5NO	Isoxazole, 5-methyl-	1A	C1
504	C4H5NS	4-Methylthiazole	1A	C1
505	C5H6S	Thiophene, 2-methyl-	1A'	Cs
506	C5H6S	Thiophene, 3-methyl-	1A'	Cs
507	C4H6O2	2-Propenoic acid, methyl ester	1A	C1
508	C4H6OS	Dihydro-2-(3H)-thiophenone	1A	C1
509	C4H6OS	Dihydro-3-(2H)-thiophenone	1A	C1
510	CH6N4S	Carbonothioic dihydrazide	1A	C2
511	C2H6N2O2	(E)-Azodioxymethane	1Ag	C2h
512	C2H6N2O2	Dimethylnitroamine	1A	C1
513	C3H6O3	1,3,5-Trioxane	1A1	C1
514	C3H6S3	Carbonotrithioic acid, dimethyl ester	1A1	C1
515	C2H6O3S	Sulfurous acid, dimethyl ester	1A'	C1
516	C4H7NO	2-Pyrrolidinone	1A	C1
517	C4H7NO	Methacrylamide	1A	C1
518	C4H7NO	Oxazole, 4,5-dihydro-2-methyl-	1A'	C1
519	CH3CH(CH3)ONO	Isopropyl nitrite	1A	C1
520	NH2COOC2H5	Urethane	1A	C1
521	C5H8O	2H-Pyran, 3,4-dihydro-	1A	C1
522	C5H8O	Furan, 2,3-dihydro-5-methyl-	1A	C1
523	N(CH3)2CONH2	Urea, N,N-dimethyl-	1A	C1
524	NH2CONHC2H5	Urea, ethyl-	1A	C1
525	C4H8O2	1,3-Dioxolane, 2-methyl-	1A	C1
526	C4H8O2	1,4-Dioxane	1Ag	C2h
527	C4H8O2	Ethene, 1,1-dimethoxy-	1A1	C2v
528	C4H8OS	s-Ethyl thioacetate	1A	C1
529	C3H8O3	1,2,3-Propanetriol	1A	C1
530	C3H8O2S	(Methylsulfonyl)ethane	1A	C1
531	C4H9NO	Butanamide	1A	C1
532	C4H9NO	Propanamide, 2-methyl-	1A	C1
533	C5H10O	2-Butanone, 3-methyl-	1A	C1
534	C5H10O	2H-Pyran, tetrahydro-	1A'	C1
535	C5H10O	2-Pentanone	1A'	Cs
536	C5H10O	3-Pentanone	1A1	C2v
537	C5H10O	Cyclopentanol	1A	C1
538	C5H10O	Oxetane, 3,3-dimethyl-	1A'	Cs
539	C5H10S	2H-Thiopyran, tetrahydro-	1A'	Cs
540	C5H10S	3-Ethylthio-1-propene	1A'	C1
541	C5H10S	Cyclopentanethiol	1A	C1
542	C5H10S	Thiophene, tetrahydro-2-methyl-	1A	C1
543	C5H10S	Thiophene, tetrahydro-3-methyl-	1A	C1
544	C4H10O2	1,1-Dimethoxyethane	1A'	Cs
545	C4H10O2	1,3-Butanediol	1A	C1
546	C4H10O2	1,4-Butanediol	1Ag	C2h
547	C4H10O2	Ethane, 1,2-dimethoxy-	1Ag	C2h
548	C4H10OS	Diethyl sulfoxide	1A	C1
549	C4H10S2	1,4-Butanedithiol	1Ag	C2h
550	C4H11NO	Diethylhydroxylamine	1A'	Cs
551	C5H12O	1-Butanol, 2-methyl-	1A	C1
552	C5H12O	1-Butanol, 3-methyl-	1A'	Cs
553	C5H12O	1-Pentanol	1A'	Cs
554	C5H12O	2-Butanol, 3-methyl-	1A	C1
555	C5H12O	2-Pentanol	1A	C1
556	C5H12O	Butane, 1-methoxy-	1A'	Cs
557	C5H12O	Propane, 1-ethoxy-	1A'	Cs
558	C5H12O	Propane, 2-methoxy-2-methyl-	1A'	C1
559	C5H12S	1-Butanethiol, 2-methyl-	1A	C1
560	C5H12S	1-Butanethiol, 3-methyl-	1A'	C1
561	C5H12S	1-Pentanethiol	1A'	C1
562	C5H12S	1-Propanethiol, 2,2-dimethyl-	1A'	C1
563	C5H12S	2-Butanethiol, 3-methyl-	1A	C1
564	C5H12S	Butane, 1-(methylthio)-	1A'	Cs
565	C5H12S	Ethyl propyl sulfide	1A'	Cs
566	C5H12S	Propane, 2-(ethylthio)-	1A'	C1
567	C5H12S	Propane, 2-methyl-2-(methylthio)-	1A'	C1
568	CF3CN	Acetonitrile, trifluoro-	1A1	C3v
569	B2F4	Diboron tetrafluoride	1A1	D2d
570	B2Cl4	Diboron tetrachloride	1A1	D2
571	C2F4	Tetrafluoroethylene	1Ag	D2h
572	C2Cl4	Tetrachloroethylene	1Ag	D2h
573	PF5	Phosphorus pentafluoride	1A1'	D3h
574	PCl5	Phosphorus pentachloride	1A1'	C4v
575	C3H5ClO2	Carbonochloridic acid, ethyl ester	1A	C1
576	C3H5Cl3	Propane, 1,2,3-trichloro-	1A'	Cs
577	C4H8Cl2	1,4-Dichlorobutane	1Ag	C2h
578	C4H8Cl2	Butane, 1,2-dichloro-	1A	C1
579	C4H8Cl2	Butane, 1,3-dichloro-	1A	C1
580	C4H8Cl2	Butane, 2,3-dichloro-, (r*,s*)-	1Ag	Ci
581	C4H9ClO	1-Chloro-2-ethoxyethane	1A'	Cs
582	C5H11Cl	Pentane, 1-chloro-	1A'	Cs
583	C2F6	hexafluoroethane	1A1g	D3d

Species NOT done yet

count	Species	Name	file name	problem
1	D-	Deuterium atom anion	d-
2	D+	Deuterium atom cation	d+
3	H2-	hydrogen diatomic anion	h2-
4	H2+	Hydrogen cation	h2+
5	HD	Deuterium hydride	hd
6	H3+	hydrogen trimer cation	h3+
7	HeH	Helium hydride	heh
8	HeH+	Helium hydride cation	heh+
9	He2+	helium diatomic cation	he2+
10	Na	Sodium atom	na
11	K	Potassium atom	k
12	K-	Potassium atom anion	k-
13	K+	Potassium atom cation	k+
14	Cu	Copper atom	cu
15	Cu-	Copper atom anion	cu-
16	Cu+	Copper atom cation	cu+
17	LiH	Lithium Hydride	lih
18	LiH-	lithium hydride anion	lih-
19	LiH+	lithium hydride cation	lih+
20	NaH	sodium hydride	nah
21	NaH-	sodium hydride anion	nah-
22	NaH+	sodium hydride cation	nah+
23	KH	Potassium hydride	kh
24	KH+	Potassium hydrogen cation	kh+
25	CuH	Copper monohydride	cuh
26	Mg	Magnesium atom	mg
27	Ca-	Calcium atom anion	ca-
28	Ca+	Calcium atom cation	ca+
29	Zn	Zinc atom	zn
30	Zn-	Zinc atom anion	zn-
31	Zn+	Zinc atom cation	zn+
32	BeH	beryllium monohydride	beh
33	BeH-	berylium monohydride anion	beh-
34	BeH+	beryllium monohydride cation	beh+
35	MgH	magnesium monohydride	mgh
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	ZnH+	Zinc, protonated	znh+
43	BeH2	beryllium dihydride	beh2
44	BeH2+	Beryllium dihydride cation	beh2+
45	MgH2	magnesium dihydride	mgh2
46	CaH2	Calcium Hydride	cah2
47	ZnH2	Zinc hydride	znh2
48	Sc	Scandium atom	sc
49	Sc+	Scandium cation	sc+
50	Ga	Gallium atom	ga
51	Ga-	Gallium atom anion	ga-
52	Ga+	Gallium atom cation	ga+
53	BH-	boron monohydride anion	bh-
54	BH+	boron monohydride cation	bh+
55	AlH-	aluminum monohydride anion	alh-
56	AlH+	aluminum monohydride cation	alh+
57	ScH	Scandium monohydride	sch
58	ScH+	Scandium monohydride cation	sch+
59	GaH	Gallium monohydride	gah
60	GaH+	Gallium monohydride cation	gah+
61	BH2-	boron dihydride anion	bh2-
62	BH2+	Boron dihydride cation	bh2+
63	AlH2-	aluminum dihydride anion	alh2-
64	AlH2+	aluminum dihydride cation	alh2+
65	BH3-	boron trihydride anion	bh3-
66	BH3+	boron trihydride cation	bh3+
67	AlH3-	aluminum trihydride anion	alh3-
68	AlH3+	aluminum trihydride cation	alh3+
69	ScH3	Scandium trihydride	sch3
70	GaH3	Gallium trihydride	gah3
71	BH4	borohydride	bh4
72	BH4-	borohydride anion	bh4-
73	AlH4-	Aluminum tetrahydride anion	alh4-
74	Ti	Titanium atom	ti
75	Ti-	Titanium atom anion	ti-
76	Ti+	Titanium atom cation	ti+
77	Ge	Germanium atom	ge
78	Ge-	Germanium anion	ge-
79	Ge+	Germanium cation	ge+
80	Sn	Tin atom	sn
81	Sn+	Tin cation	sn+
82	CH-	methylidyne anion	ch-
83	CH+	Methylidyne cation	ch+
84	SiH-	silicon monohydride anion	sih-
85	SiH+	silicon monohydride cation	sih+
86	GeH	germylidene	geh
87	GeH+	Germaniun monohyrdide cation	geh+
88	CH2-	methylene anion	ch2-
89	CH2+	methylene cation	ch2+
90	SiH2-	silicon dihydride anion	sih2-
91	SiH2+	silicon dihydride cation	sih2+
92	GeH2	germylene	geh2
93	GeH2-	germylene anion	geh2-
94	CH3-	methyl anion	ch3-
95	CH3+	methyl cation	ch3+
96	SiH3-	Silyl anion	sih3-
97	SiH3+	Silyl cation	sih3+
98	GeH3	Germyl radical	geh3
99	GeH3+	germyl cation	geh3+
100	CD4	methane-d4	cd4
101	CH2D2	methane-d2	ch2d2
102	CH3D	methane-d	ch3d
103	CH4-	Methane anion	ch4-
104	CH4+	Methane cation	ch4+
105	CHD3	methane-d3	chd3
106	SiH2D2	silane-d2	sih2d2
107	SiH4+	Silane cation	sih4+
108	GeH4	Germane	geh4
109	SnH4	Stannane	snh4
110	SiH5+	Silane, protonated	sih5+
111	N	Nitrogen atom	n
112	V	Vanadium atom	v
113	V+	Vanadium atom cation	v+
114	As-	Arsenic anion	as-
115	As+	Arsenic cation	as+
116	Sb	Antimony atom	sb
117	NH-	Imidogen anion	nh-
118	NH+	imidogen cation	nh+
119	PH-	phosphorus monohydride anion	ph-
120	PH+	phosphorus monohydride cation	ph+
121	AsH	Arsenic monohydride	ash
122	AsH+	Arsenic monohydride cation	ash+
123	SbH	Antimony monohydride	sbh
124	NH2-	amino anion	nh2-
125	NH2+	Amino cation	nh2+
126	PH2-	Phosphino anion	ph2-
127	PH2+	Phosphino cation	ph2+
128	AsH2	Arsenic dihydride	ash2
129	AsH2+	Arsenic dihydride cation	ash2+
130	NH3-	Ammonia anion	nh3-
131	NH3+	ammonia cation	nh3+
132	PH3+	Phosphine cation	ph3+
133	AsH3	Arsine	ash3
134	AsH3+	Arsine cation	ash3+
135	SbH3	Stibine	sbh3
136	AsH4+	Arsonium	ash4+
137	NH4	Ammonium radical	nh4
138	NH4+	ammonium cation	nh4+
139	PH4	Phosphoranyl radical	ph4
140	PH4+	phosphonium cation	ph4+
141	Cr	Chromium atom	cr
142	Te	Tellurium atom	te
143	Te+	Tellurium atom cation	te+
144	OH-	hydroxide anion	oh-
145	OH+	hydoxyl cation	oh+
146	HS-	mercapto anion	sh-
147	HS+	sulfur monohydride cation	sh+
148	CrH	Chromium hydride	crh
149	CrH+	Chromium hydride cation	crh+
150	HSe	Selenium monohydride	hse
151	HSe-	selenium monohydride anion	hse-
152	HSe+	selenium monohydride cation	hse+
153	TeH	Telluryl radical	teh
154	H2O-	water anion	h2o-
155	H2O+	water cation	h2o+
156	H2S-	Hydrogen sulfide anion	h2s-
157	H2S+	Hydrogen sulfide cation	h2s+
158	H2Se	Hydrogen selenide	h2se
159	H2Se+	Hydrogen selenide cation	h2se+
160	H2Te	Hydrogen Telluride	h2te
161	H3O+	hydronium cation	h3o+
162	H3S+	Sulfonium cation	h3s+
163	H3Se+	Hydrogen Selenide, protonated	h3se+
164	Mn	Manganese atom	mn
165	I	Iodine atom	iodine
166	I-	Iodine atom anion	iodine-
167	I+	Iodine atom cation	iodine+
168	HF-	hydrogen fluoride anion	hf-
169	HF+	hydrogen fluoride cation	hf+
170	HCl-	hydrogen chloride anion	hcl-
171	HCl+	hydrogen chloride cation	hcl+
172	HBr	hydrogen bromide	hbr
173	HBr-	hydrogen bromide anion	hbr-
174	HBr+	hydrogen bromide cation	hbr+
175	HI	Hydrogen iodide	hi
176	HI+	Hydrogen iodide cation	hi+
177	H2F+	dihydrogen fluoride cation	h2f+
178	H2Cl+	dihydrogen monochloride cation	h2cl+
179	H2Br+	protonated hydrogen bromide	h2br+
180	H2I+	Iodonium	h2i+
181	Fe	Iron atom	fe
182	Kr	Krypton atom	kr
183	Kr+	Krypton cation	kr+
184	Xe	Xenon atom	xe
185	HeLi+	Helium Lithium cation	heli+
186	NeH	neon hydrogen	neh
187	NeH+	neon hydrogen cation	neh+
188	ArH+	Argon hydride cation	arh+
189	KrH+	Protonated Krypton	krh+
190	XeH+	Xenon, protonated	xeh+
191	H2Ar	H2 Ar dimer	h2ar
192	Co	Cobalt atom	cobalt
193	Ni	Nickel atom	ni
194	Li2	Lithium diatomic	li2
195	Li2-	lithium diatomic anion	li2-
196	Li2+	lithium diatomic cation	li2+
197	NaLi	lithium sodium	lina
198	NaLi-	lithium sodium anion	lina-
199	NaLi+	lithium sodium cation	lina+
200	LiK	Lithium Potassium	lik
201	Na2	Sodium diatomic	na2
202	Na2-	sodium diatomic anion	na2-
203	Na2+	sodium diatomic cation	na2+
204	NaK	Sodium Potassium	nak
205	NaK+	Sodium Potassium diatomic cation	nak+
206	K2	Potassium diatomic	k2
207	Cu2	Copper diatomic	cu2
208	LiBe	Lithium Beryllium	libe
209	LiMg	Lithium magnesium	limg
210	NaBe	Sodium Beryllium	nabe
211	NaMg	Sodium Magnesium	namg
212	Be2	Beryllium diatomic	be2
213	Be2-	Beryllium diatomic anion	be2-
214	Be2+	Beryllium diatomic cation	be2+
215	BeMg	Beryllium Magnesium	bemg
216	Mg2	Magnesium diatomic	mg2
217	Mg2-	magnesium diatomic anion	mg2-
218	Mg2+	magnesium diatomic cation	mg2+
219	Ca2	Calcium diatomic	ca2
220	LiB	Lithium boride	lib
221	LiAl	Lithium Aluminum	lial
222	NaAl	Sodium aluminum	naal
223	BeB	Beryllium monoboride	beb
224	B2	Boron diatomic	b2
225	B2-	Boron diatomic anion	b2-
226	B2+	Boron diatomic cation	b2+
227	BAl	Boron Aluminum	bal
228	Al2-	aluminum diatomic anion	al2-
229	Al2+	aluminum diatomic cation	al2+
230	BGa	Boron Gallium	bga
231	AlGa	Aluminum Gallium	alga
232	Ga2	Gallium diatomic	ga2
233	HBBH	Diborane(2)	hbbh
234	LiBH4	Lithium borohydride	libh4
235	B2H4	Diborane(4) D2d	b2h4
236	HBHHBH	Diborane(4) C2V	hbhhbh
237	B2H6+	Diborane cation	b2h6
238	Al2H6	dialane	al2h6
239	Ga2H6	digallane	ga2h6
240	LiC	Lithium Carbide	lic
241	BeC	Beryllium Carbide	bec
242	CaC	Calcium monocarbide	cac
243	BC	boron monocarbide	bc
244	BC-	boron monocarbide anion	bc-
245	BC+	boron monocarbide cation	bc+
246	AlC	Aluminum carbide	alc
247	BSi	Boron silicide	bsi
248	C2-	carbon diatomic anion	c2-
249	C2+	carbon diatomic cation	c2+
250	SiC	silicon monocarbide	sic
251	SiC-	silicon monocarbide anion	sic-
252	SiC+	silicon monocarbide cation	sic+
253	Si2-	silcon diatomic anion	si2-
254	Si2+	silcon diatomic cation	si2+
255	GeC	Germanium monocarbide	gec
256	SiGe	Silicon Germanium	sige
257	Ge2	Germanium diatomic	ge2
258	C2H-	Ethynyl anion	c2h-
259	C2H+	Ethynyl cation	c2h+
260	ZnCH2	Zinc methylene	znch2
261	C2H2+	acetylene cation	c2h2+
262	CCH2	vinylidene	vinylidene
263	H2CC-	vinylidene anion	h2cc-
264	HCCH-	acetylene anion	c2h2-
265	Si2H2	disilyne	si2h2
266	CH3Li	methyl lithium	ch3li
267	CuCH3	monomethyl copper	cuch3
268	ZnCH3	Zinc monomethyl	znch3
269	CH2BH	methyleneborane	ch2bh
270	C2H3-	vinyl anion	c2h3-
271	C2H3+	vinyl cation	c2h3+
272	C2H4-	Ethylene anion	c2h4-
273	C2H4+	Ethylene cation	c2h4+
274	CH3CH	methylmethylene	ch3ch
275	CH2SiH2	silaethylene	ch2sih2
276	Si2H4	Disilene	si2h4
277	CH3BH2	methylborane	ch3bh2
278	C2H5-	Ethyl anion	c2h5-
279	C2H5+	Ethyl cation	c2h5+
280	C2H6+	ethane cation	c2h6+
281	GeH3CH3	methyl germane	geh3ch3
282	C2H7+	Ethane, protonated	c2h7+
283	LiN	Lithium Nitride	lin
284	LiN+	Lithium Nitride cation	lin+
285	LiP	Lithium monophosphide	lip
286	BeN	Beryllium mononitride	ben
287	BeN-	Beryllium mononitride anion	ben-
288	BeN+	Beryllium mononitride cation	ben+
289	MgN	Magnesium Nitride	mgn
290	BN-	boron nitride anion	bn-
291	AlN-	aluminum mononitride anion	aln-
292	AlN+	aluminum mononitride cation	aln+
293	BP	Boron monophosphide	bp
294	AlP	Aluminum monophosphide	alp
295	GaN	Gallium mononitride	gan
296	GaP	Gallium monophosphide	gap
297	GaAs	Gallium arsenide	gaas
298	BN	boron nitride	bn
299	BN+	boron nitride cation	bn+
300	AlN	Aluminum nitride	aln
301	CN-	cyanide anion	cn-
302	CN+	Cyano cation	cn+
303	CP-	carbon monophosphide anion	cp-
304	CP+	carbon monophosphide cation	cp+
305	SiN-	silicon mononitride anion	sin-
306	SiN+	silicon mononitride cation	sin+
307	SiP	Silicon monophosphide	sip
308	SiP-	Silicon monophosphide anion	sip-
309	SiP+	Silicon monophosphide cation	sip+
310	TiN	Titanium mononitride	tin
311	N2-	nitrogen diatomic anion	n2-
312	N2+	diatomic nitrogen cation	n2+
313	PN-	phosphorus nitride anion	pn-
314	PN+	phosphorus nitride cation	pn+
315	P2-	phosphorus diatomic anion	p2-
316	P2+	phosphorus diatomic cation	p2+
317	AsN	Arsenic mononitride	asn
318	AsP	Arsenic monophosphide	asp
319	SbN	Antimony nitride	sbn
320	As2	Arsenic diatomic	as2
321	HNB	hydrogen nitrogen boron	hnb
322	HNC	hydrogen isocyanide	hnc
323	HCN-	Hydrogen cyanide anion	hcn-
324	HCN+	hydrogen cyanide cation	hcn+
325	HNC+	hydrogen isocyanide cation	hnc+
326	HCP+	Phosphaethyne cation	hcp+
327	NNH	Dinitrogen monohydride	nnh
328	NNH+	Dinitrogen monohydride cation	nnh+
329	HPO+	Hydrogen phosphorus oxide cation	hpo+
330	LiNH2	lithium amide	linh2
331	HBNH	Boranimine	hbnh
332	CNH2	Aminomethylidyne radical	cnh2
333	CNH2+	N-protonated hydrogen isocyanide	cnh2+
334	H2CN	Dihydrogen cyanide radical	h2cn
335	H2CN+	hydrocyanonium cation	h2cn+
336	HCNH	methyleneazane	hcnh
337	HCNH+	N-protonated HCN	hcnh+
338	H2NN	Isodiazene	h2nn
339	N2H2	(E)-diazene	n2h2
340	N2H2	(Z)-Diazene	n2h2z
341	N2H2+	trans-diazene cation	n2h2+
342	CH2NH+	Methanimine cation	ch2nh+
343	CHNH2	aminomethylene	chnh2
344	CHNH2+	Aminocarbene cation	chnh2+
345	CH2PH	Phosphaethene	ch3p
346	BH2NH2	Boranamine	bh2nh2
347	CH2NH2+	methyleneamine cation	ch2nh2+
348	N2H4+	hydrazine cation	n2h4+
349	CH3NH2+	methyl amine cation	ch3nh2+
350	SiH3NH2	Silane, amino	sih3nh2
351	N2H5+	protonated hydrazine	n2h5+
352	BH3PH3	borane phosphine	bh3ph3
353	BH3NH3	borane ammonia	bh3nh3
354	CH3NH3	methyl ammonium radical	ch3nh3
355	CH3NH3+	protonated methylamine	ch3nh3+
356	CH3PH3+	methyl phosphine, protonated	ch3ph3+
357	NH3NH3	Ammonia Dimer	nh3nh3
358	N2H7+	ammonia ammonium dimer	n2h7+
359	LiO	lithium oxide	lio
360	LiO-	lithium oxide anion	lio-
361	LiO+	lithium oxide cation	lio+
362	LiS	Lithium monosulfide	lis
363	LiS+	Lithium sulfide cation	lis+
364	NaO	sodium monoxide	nao
365	NaO-	sodium oxide anion	nao-
366	NaO+	sodium oxide cation	nao+
367	KO	Potassium monoxide	ko
368	KO+	Potassium monoxide cation	ko+
369	NaS	Sodium sulfide	nas
370	CuO	Copper Monoxide	cuo
371	LiSe	Lithium monoselenide	lise
372	BeO	beryllium oxide	beo
373	BeO-	Beryllium monoxide anion	beo-
374	BeO+	Beryllium monoxide cation	beo+
375	BeS	beryllium sulfide	bes
376	MgO	magnesium oxide	mgo
377	MgO-	magnesium oxide anion	mgo-
378	MgO+	magnesium oxide cation	mgo+
379	CaO	Calcium monoxide	cao
380	MgS	magnesium sulfide	mgs
381	MgS-	magnesium sulfide anion	mgs-
382	MgS+	magnesium sulfide cation	mgs+
383	CaS	Calcium sulfide	cas
384	ZnO	zinc monoxide	zno
385	ZnS	Zinc sulfide	zns
386	BeS-	Beryllium monosulfide anion	bes-
387	BeS+	Beryllium monosulfide cation	bes+
388	BO-	boron monoxide anion	bo-
389	AlO-	Aluminum monoxide anion	alo-
390	AlO+	aluminum monoxide cation	alo+
391	BS-	boron monosulfide anion	bs-
392	BS+	boron monosulfide cation	bs+
393	AlS-	aluminum monosulfide anion	als-
394	AlS+	aluminum monosulfide cation	als+
395	ScO	Scandium monoxide	sco
396	GaO	Gallium monoxide	gao
397	GaS	Gallium monosulfide	gas
398	BO+	boron monoxide cation	bo+
399	CO-	carbon monoxide anion	co-
400	CO+	carbon monoxide cation	co+
401	CS-	carbon monosulfide anion	cs-
402	CS+	carbon monosulfide cation	cs+
403	SiO-	silicon monoxide anion	sio-
404	SiO+	silicon monoxide cation	sio+
405	SiS-	silicon monosulfide anion	sis-
406	SiS+	silicon monosulfide cation	sis+
407	TiO	Titanium monoxide	tio
408	CSe	Carbon monoselenide	cse
409	CSe-	Carbon monoselenide anion	cse-
410	CSe+	Carbon monoselenide cation	cse+
411	GeO	Germanium monoxide	geo
412	GeO+	Germanium monoxide cation	geo+
413	GeS	Germanium monosulfide	ges
414	SiSe	Silicon Monoselenide	sise
415	SiSe+	Silicon Monoselenide cation	sise+
416	GeSe	Germanium monoselenide	gese
417	NO-	nitric oxide anion	no-
418	NO+	nitric oxide cation	no+
419	NS-	nitrogen sulfide anion	ns-
420	NS+	nitrogen sulfide cation	ns+
421	PO-	phosphorus monoxide anion	po-
422	PO+	phosphorus monoxide cation	po+
423	PS-	phosphorus monosulfide anion	ps-
424	PS+	phosphorus monosulfide cation	ps+
425	VO	Vanadium monoxide	vo
426	AsO	Arsenic monoxide	aso
427	NSe	Nitrogen monoselenide	nse
428	AsS	Arsenic monosulfide	ass
429	PSe	Phosphorus monoselenide	pse
430	AsSe	Arsenic monoselenide	asse
431	O2-	oxygen diatomic anion	o2-
432	O2--	dioxygen dianion	o2--
433	O2+	diatomic oxygen cation	o2+
434	SO-	sulfur monoxide anion	so-
435	SO+	sulfur monoxide cation	so+
436	S2-	sulfur diatomic anion	s2-
437	S2+	sulfur diatomic cation	s2+
438	SeO	Selenium monoxide	seo
439	SeO-	selenium monoxide anion	seo-
440	SeO+	selenium monoxide cation	seo+
441	SeS	Selenium monosulfide	ses
442	SeS-	selenium monosulfide anion	ses-
443	SeS+	selenium monosulfide cation	ses+
444	TeO	Tellurium monoxide	teo
445	Se2	Selenium diatomic	se2
446	Se2-	selenium diatomic anion	se2-
447	Se2+	selenium diatomic cation	se2+
448	Te2	Tellurium diatomic	te2
449	LiOH	lithium hydroxide	lioh
450	NaOH	sodium hydroxide	naoh
451	KOH	Potassium hydroxide	koh
452	BeOH	beryllium monohydroxide	beoh
453	MgOH	magnesium hydroxide	mgoh
454	CaOH	Calcium monohydroxide	caoh
455	COH	Hydroxymethylidyne	coh
456	COH+	Carbon Monoxide, protonated	coh+
457	HCO-	formyl anion	hco-
458	HCO+	Formyl cation	hco+
459	HCS	Thioformyl radical	hcs
460	HCS-	Thioformyl anion	hcs-
461	HCS+	Thioformyl cation	hcs+
462	HNO-	Nitrosyl hydride anion	hno-
463	HNO+	Nitrosyl hydride cation	hno+
464	NOH	Hydroxyimidogen	noh
465	NOH+	O-protonated nitric oxide	noh+
466	HNS	Sulfur imide	hns
467	HNS-	Sulfur imide anion	hns-
468	HO2-	Hydroperoxy anion	ho2-
469	HO2+	Hydroperoxy cation	ho2+
470	HSO+	Sulfur Monoxide, S-protonated	HSO+
471	SOH	Sulfur Hydroxide	soh
472	SOH+	Sulfur Monoxide, protonated	soh+
473	HS2	Thiosulfeno radical	hs2
474	H2CO-	formaldehyde anion	h2co-
475	H2CO+	formaldehyde cation	h2co+
476	HOCH	hydroxycarbene	hoch
477	H2CS-	thioformaldehyde anion	h2cs-
478	H2CS+	thioformaldehyde cation	h2cs+
479	H2CSe	Selenoformaldehyde	h2cse
480	H2NO	nitroxide	h2no
481	H2O2+	Hydrogen peroxide cation	h2o2+
482	H2OO	water oxide	h2oo
483	HOSH	hydrogen thioperoxide	hosh
484	H2S2+	hydrogen disulfide cation	h2s2+
485	H2Se2	hydrogen diselenide	h2se2
486	CH2OH+	hydroxymethyl cation	ch2oh+
487	CH3O-	methoxy anion	ch3o-
488	CH3O+	Methoxy cation	ch3o+
489	H2CSH+	Thioformaldehyde, protonated	h2csh+
490	NH2OH+	Hydroxylamine cation	nh2oh+
491	NH3O	Ammonia Oxide	nh3o
492	H2POH	Phosphinous acid	h2poh
493	H3PO	Phosphine oxide	h3po
494	NH2SH	Thiohydroxylamine	nh2sh
495	NH3S	sulfidoazane	nh3s
496	H3O2+	hydrogen peroxide, protonated	h3o2+
497	CH3OH-	Methyl alcohol anion	ch3oh-
498	CH3OH+	Methyl alcohol cation	ch3oh+
499	CH3SH+	Methanethiol cation	ch3sh+
500	SiH3OH	silanol	sih3oh
501	CH3SeH	Methane selenol	ch3seh
502	NH2OH2+	protonated hydroxylamine	nh2oh2+
503	NH3OH+	N-protonated hydroxylamine	nh3oh+
504	H2OH2O	water dimer	h2oh2o
505	CH3OH2+	Methanol, protonated	ch3oh2+
506	CH3SH2+	protonated methylsulfide	ch3sh2+
507	H2ONH3	Water Ammonia Dimer	h2onh3
508	H5O2+	Dihydroxonium ion	h5o2+
509	LiF	lithium fluoride	lif
510	LiCl	lithium chloride	licl
511	LiCl-	lithium chloride anion	licl-
512	LiCl+	lithium chloride cation	licl+
513	NaF	sodium fluoride	naf
514	NaF-	sodium fluoride anion	naf-
515	NaF+	sodium fluoride cation	naf+
516	KF	Potassium Fluoride	kf
517	NaCl	Sodium Chloride	nacl
518	NaCl-	sodium chloride anion	nacl-
519	NaCl+	sodium chloride cation	nacl+
520	KCl	Potassium Chloride	kcl
521	CuF	Copper monofluoride	cuf
522	LiBr	Lithium Bromide	libr
523	LiBr-	lithium bromide anion	libr-
524	LiBr+	lithium bromide cation	libr+
525	CuCl	Copper monochloride	cucl
526	NaBr	Sodium Bromide	nabr
527	NaBr-	sodium bromide anion	nabr-
528	NaBr+	sodium bromide cation	nabr+
529	KBr	Potassium Bromide	kbr
530	LiI	Lithium Iodide	lii
531	NaI	Sodium Iodide	nai
532	KI	Potassium Iodide	ki
533	LiF-	lithium fluoride anion	lif-
534	LiF+	lithium fluoride cation	lif+
535	BeF	Beryllium monofluoride	bef
536	BeF-	Beryllium monofluoride anion	bef-
537	BeF+	Beryllium monofluoride cation	bef+
538	BeCl	beryllium monochloride	becl
539	MgF	Magnesium monofluoride	mgf
540	MgF-	magnesium fluoride anion	mgf-
541	MgF+	magnesium fluoride cation	mgf+
542	CaF	Calcium monofluoride	caf
543	MgCl	magnesium monochloride	mgcl
544	MgCl-	magnesium monochloride anion	mgcl-
545	MgCl+	magnesium monochloride cation	mgcl+
546	CaCl	calcium monochloride	cacl
547	TiCl	Titanium Monochloride	ticl
548	ZnF	Zinc monofluoride	znf
549	ZnF-	Zinc monofluoride anion	znf-
550	ZnF+	Zinc monofluoride cation	znf+
551	ZnCl	Zinc monochloride	zncl
552	CaBr	Calcium monobromide	cabr
553	BeCl-	beryllium monochloride anion	becl-
554	BeCl+	beryllium monochloride cation	becl+
555	BF	Boron monofluoride	bf
556	BF-	Boron monofluoride anion	bf-
557	BF+	Boron monofluoride cation	bf+
558	AlF-	Aluminum monofluoride anion	alf-
559	AlF+	Aluminum monofluoride cation	alf+
560	BCl-	boron monochloride anion	bcl-
561	BCl+	boron monochloride cation	bcl+
562	AlCl	Aluminum monochloride	alcl
563	AlCl-	aluminum monochloride anion	alcl-
564	AlCl+	aluminum monochloride cation	alcl+
565	ScF	Scandium monofluoride	scf
566	BBr	Boron monobromide	bbr
567	GaF	Gallium monofluoride	gaf
568	GaF+	Gallium monofluoride cation	gaf+
569	AlBr	Aluminum monobromide	albr
570	GaCl	Gallium monochloride	gacl
571	GaCl+	Gallium monochloride cation	gacl+
572	AlI	Aluminum monoiodide	ali
573	GaBr	Gallium monobromide	gabr
574	CF-	carbon monofluoride anion	cf-
575	CF+	carbon monofluoride cation	cf+
576	CCl-	carbon monochloride anion	ccl-
577	CCl+	carbon monochloride cation	ccl+
578	SiF-	silicon monofluoride anion	sif-
579	SiF+	silicon monofluoride cation	sif+
580	SiCl-	silicon monochloride anion	sicl-
581	SiCl+	silicon monochloride cation	sicl+
582	CBr	Carbon monobromide	cbr
583	GeF	Germanium monofluoride	gef
584	GeF+	Germanium monofluoride cation	gef+
585	GeCl	Germanium monochloride	gecl
586	GeCl+	Germanium monochloride cation	gecl+
587	SiBr	Silicon monobromide	sibr
588	SiBr+	Silicon monobromide cation	sibr+
589	NF-	nitrogen monofluorine anion	nf-
590	NF+	nitrogen monofluoirde cation	nf+
591	NCl	nitrogen monochloride	ncl
592	NCl-	nitrogen monochloride anion	ncl-
593	NCl+	nitrogen monochloride cation	ncl+
594	PF-	phosphorus monofluoride anion	pf-
595	PF+	phosphorus monofluoride cation	pf+
596	PCl-	phosphorus monochloride anion	pcl-
597	PCl+	phosphorus monochloride cation	pcl+
598	AsF	Arsenic monofluoride	asf
599	NBr	nitrogen monobromide	nbr
600	AsCl	Arsenic monochloride	ascl
601	PBr	Phosphorus monobromide	pbr
602	SbF	Antimony monofluoride	sbf
603	SbCl	Antimony monochloride	sbcl
604	FO-	flourine oxide anion	fo-
605	FO+	fluorine monoxide cation	fo+
606	ClO-	chlorine monoxide anion	clo-
607	ClO+	chlorine monoxide cation	clo+
608	SF-	sulfur monofluoride anion	sf-
609	SF+	sulfur monofluoride cation	sf+
610	SCl-	sulfur monochloride anion	scl-
611	SCl+	sulfur monochloride cation	scl+
612	BrO	Bromine monoxide	bro
613	BrO-	Bromine monoxide anion	bro-
614	BrO+	Bromine monoxide cation	bro+
615	SeF	Selenium monofluoride	sef
616	SBr	Sulfur monobromide radical	sbr
617	SBr+	Sulfur monobromide cation	sbr+
618	SeCl	Selenium monochloride	secl
619	IO	Iodine monoxide	io
620	SeBr	Selenium monobromide	sebr
621	BrCl	Bromine monochloride	brcl
622	F2-	flourine diatomic anion	f2-
623	F2+	flourine diatomic cation	f2+
624	ClF-	clorine monofluoride anion	clf-
625	ClF+	clorine monofluoride cation	clf+
626	Cl2-	chlorine diatomic anion	cl2-
627	Cl2+	chlorine diatomic cation	cl2+
628	BrF	Bromine monofluoride	brf
629	BrF-	bromine fluoride anion	brf-
630	BrF+	bromine fluoride cation	brf+
631	BrCl-	bromine chloride anion	brcl-
632	BrCl+	bromine chloride cation	brcl+
633	IF	Iodine monofluoride	if
634	Br2	Bromine diatomic	br2
635	Br2-	bromine diatomic anion	br2-
636	Br2+	bromine diatomic cation	br2+
637	ICl	Iodine monochloride	icl
638	IBr	Iodine monobromide	ibr
639	I2	Iodine diatomic	i2
640	I2+	Iodine diatomic cation	i2+
641	HCCl	Chloromethylene	hccl
642	HSiF	fluorosilylene	hsif
643	HSiCl	Chlorosilylene	hsicl
644	HSiBr	monobromosilylene	hsibr
645	CHBr	bromomethylene	chbr
646	HOCl+	hypochlorous acid cation	hocl+
647	HOBr	Hypobromous acid	hobr
648	HOBr+	Hypobromous acid cation	hobr+
649	HOI	Hypoiodous acid	hoi
650	F2H+	Fluorine, protonated	f2h+
651	FHF	Hydrogen difluoride	fhf
652	FHF-	Hydrogen difluoride anion	fhf-
653	ClFH+	Chlorine fluoride, F-protonated	clfh+
654	FClH+	Chlorine fluoride, Cl-protonated	fclh+
655	Cl2H+	Chlorine, protonated	cl2h+
656	CH2Br	bromomethyl radical	ch2br
657	CH2F	fluoromethyl radical	ch2f
658	CH2F+	fluoromethyl cation	ch2f+
659	CH2Cl+	chloromethyl cation	ch2cl+
660	CH2Cl	chloromethyl radical	ch2cl
661	NH2F	monofluoroamine	nh2f
662	NH2Cl	chloramine	nh2cl
663	CH3F+	methyl fluoride cation	ch3f+
664	CD3F	methylfluoride-d3	cd3f
665	CD3Cl	methyl chloride d3	cd3cl
666	CH3Cl+	Methyl chloride cation	ch3cl+
667	CH3Br	methyl bromide	ch3br
668	GeH3F	monofluorogermane	geh3f
669	GeH3Cl	monochlorogermane	geh3cl
670	SiH3Br	bromosilane	sih3br
671	CH3I	methyl iodide	ch3i
672	SiH3I	Silyl Iodide	sih3i
673	NH3Cl+	protonated monochloroammonia	nh3cl+
674	CH3ClH+	methyl chloride, protonated	ch3clh+
675	NH4Cl	Ammonium chloride	nh4cl
676	LiNe+	Lithium Neon cation	line+
677	Ne2	Neon diatomic	ne2
678	Ne2+	Neon diatomic cation	ne2+
679	Ar2	Argon diatomic	ar2
680	Ar2+	Argon diatomic cation	ar2+
681	Li3	Lithium trimer	li3
682	Li3+	Lithium trimer cation	li3+
683	C3+	carbon trimer cation	c3+
684	SiC2	Silicon dicarbide	sic2
685	C3H3	cyclopropenyl radical	cpr
686	C3H3-	Propargyl anion	c3h3-
687	C3H3+	cyclopropenyl cation	cpr+
688	C3H3+	Propargyl cation	c3h3+
689	C3H4	cyclopropene	cprop
690	C3H5+	Allyl cation	allyl+
691	CH3CHCH	1-propenyl radical	ch3chch
692	Zn(CH3)2	dimethyl zinc	dmz
693	C3H7+	cyclopropane, protonated	c3h7+
694	CH3CHCH3+	Isopropyl cation	prop2yl+
695	SiH2(CH3)2	dimethylsilane	dms
696	Si3H8	trisilane	si3h8
697	LiCN	lithium cyanide	licn
698	NaCN	Sodium Cyanide	nacn
699	KCN	Potassium cyanide	kcn
700	CuCN	Copper cyanide	cucn
701	ZnCN	Zinc monocyanide	zncn
702	ZnNC	Zinc isocyanide	znnc
703	AlCN	Aluminum monocyanide	alcn
704	AlNC	Aluminum isocyanide	alnc
705	CN2	3H-Diazirin-3-ylidene	cn2
706	CNN	Diazocarbene	cnn
707	NCN	Cyanoimidogen	ncn
708	N3	azide radical	n3
709	N3-	azide anion	n3-
710	N3+	azide cation	n3+
711	HCCN	cyanomethylene	hccn
712	HCNN	diazomethyl radical	hcnn
713	HN3	hydrogen azide	hn3
714	HN3+	Hydrazoic acid cation	hn3+
715	HNCNH	diiminomethane	hncnh
716	CH2N2	diazirine	ch2n2
717	CH2NN	diazomethane	ch2nn
718	NH2CN	cyanamide	cyanamide
719	HNNNH+	1,2-Triazadienium	n2h3+
720	NH2NN+	hydrazoic acid, protonated	nh2nn+
721	CH3CN-	acetonitrile anion	ch3cn-
722	CH3CN+	Acetonitrile cation	ch3cn+
723	CH3NC	methyl isocyanide	ch3nc
724	CHNCH2	2H-Azirine	c157164
725	CHNHCH	1H-Azirine	chnhch
726	H2CCNH	Ethenimine	ch2cnh
727	H2CNCH	methyleneaminomethylene	ch2nch
728	HCCNH2	Ethynamine	hccnh2
729	HCNCH2+	2H-Azirine cation	hcnch2+
730	HNCNH2+	diiminomethane, protonated	hncnh2+
731	NCNH3+	Cyanamide, protonated	ncnh3+
732	NH2CNH+	cyanamide, cn protonated	nh2cnh+
733	NH3CN+	cyanamide, amine protonated	nh3cn+
734	CH2CHNH	vinylazine	ch2chnh
735	CH3CHN	methylmethaniminyl radical	ch3chn
736	NHCHNH2	aminomethanimine	cn2h4
737	CH2CHNH2	aminoethene	aminoethene
738	CH2NCH3	N-methylmethanimine	nmm
739	CH3CHNH	ethanimine	ethanimine
740	NH2BHNH2	diaminoborane	nh2bhnh2
741	C2H5NH+	Protonated Aziridine	c2h5nh+
742	C2H6N+	aziridine, protonated	c2h6n+
743	NH2CH2NH2	diaminomethane	nh2ch2nh2
744	CH3PHCH3	dimethylphosphine	ch3phch3
745	NH2CH2NH3+	diaminoethane, protonated	pdam
746	(CH3)2NH2+	dimethylammonium cation	dmam
747	CH3CH2NH3+	ethylamine, protonated	pea
748	Li2O	dilithium oxide	li2o
749	Li2O+	dilithium oxide cation	li2o+
750	Li2S	dilithium sulfide	li2s
751	Na2O	disodium monoxide	na2o
752	Na2S	Sodium sulfide	na2s
753	LiO2	Lithium dioxide	lio2
754	NaO2	Sodium superoxide	nao2
755	CCO	Dicarbon monoxide	cco
756	CNO-	fulminate	cno-
757	NCO	isocyanato radical	nco
758	NCO-	cyanate	nco-
759	SCN	thiocyanato radical	scn
760	SCN-	thiocyanide anion	scn-
761	BO2-	Boron dioxide anion	bo2-
762	BO2+	Boron dioxide cation	bo2+
763	N2O-	Nitrous oxide anion	n2o-
764	N2O+	Nitrous oxide cation	n2o+
765	NNS	Nitrogen sulfide	nns
766	PPO	Phosphorus oxide phosphide	ppo
767	CO2-	Carbon dioxide anion	co2-
768	CO2+	Carbon dioxide cation	co2+
769	OCS+	Carbonyl sulfide cation	cos+
770	CS2-	Carbon disulfide anion	cs2-
771	CS2+	Carbon disulfide cation	cs2+
772	TiO2	Titanium dioxide	tio2
773	SiS2	Silicon disulfide	sis2
774	GeO2	Germanium dioxide	geo2
775	OCSe	Carbonyl selenide	ocse
776	SCSe	Carbon sulfide selenide	scse
777	GeS2	Germanium disulfide	ges2
778	CSe2	Carbon diselenide	cse2
779	SCTe	Carbon sulfide Telluride	scte
780	NO2-	Nitrogen dioxide anion	no2-
781	NO2+	Nitrogen dioxide cation	no2+
782	NSO	sulfinyl amidogen	NSO
783	PO2-	Phosphorus dioxide anion	po2-
784	PO2+	Phosphorus dioxide cation	po2+
785	SNO	Nitrogen oxide sulfide	sno
786	AsO2	Aresenic dioxide	aso2
787	O3-	Ozone anion	o3-
788	O3+	Ozone cation	o3+
789	SO2-	Sulfur dioxide anion	so2-
790	SO2+	Sulfur dioxide cation	so2+
791	S3	Sulfur trimer	s3
792	S3-	Sulfur trimer anion	s3-
793	S3+	Sulfur trimer cation	s3+
794	SeO2	Selenium dioxide	seo2
795	SeO2+	Selenium dioxide cation	seo2+
796	TeO2	Tellurium Dioxide	teo2
797	HCCO	ketenyl radical	ketenyl
798	CS2H+	Carbon disulfide, protonated	cs2h+
799	HCNO	fulminic acid	hcno
800	HOCN	cyanic acid	hocn
801	HNCS	Isothiocyanic acid	hncs
802	HSCN	thiocyanic acid	hscn
803	HCO2-	formate anion	hco2-
804	HNNO	nitrosoazane	hnno
805	HNNO+	Nitrous oxide, N-protonated	hnno+
806	NNOH+	Nitrous Oxide, O-protonated	nnoh+
807	HCOO	formate neutral radical	hcoo
808	HOCO	Hydrocarboxyl radical	hoco
809	HOCO+	Hydrocarboxyl cation	hoco+
810	HNO2+	nitrous acid cation	hno2+
811	O3H+	protonated ozone	o3h+
812	SO2H+	protonated sulfur dioxide	so2h+
813	C2H2O	Oxirene	oxirene
814	CH2CO+	Ketene cation	ch2co+
815	HCCOH	ethynol	hccoh
816	CH2CS	Thioketene	ch2cs
817	Be(OH)2	Beryllium hydroxide	beo2h2
818	Mg(OH)2	Magnesium dihydroxide	h2mgo2
819	NH2NO	Nitrosamide	nh2no
820	CH2O2	Dioxirane	diox
821	H2COO	Dioxymethyl radical	h2coo
822	H2COO+	dioxymethyl cation	h2coo+
823	H2O3	Hydrogen trioxide	h2o3
824	HSSSH	trisulfane	hsssh
825	NaOCH3	Sodium methoxide	naoch3
826	CH2BOH	hydroxy(methylene)borane	ch2boh
827	BH3CO	Borane carbonyl	bh3co
828	CH3BO	Borane, methyloxo-	ch3bo
829	CH2CHO	Vinyloxy radical	ch2cho
830	CH2COH+	ketene, protonated	ch2coh+
831	CH3CO-	Acetyl anion	ch3co-
832	CH3CO+	acetyl cation	ch3co+
833	CH2NOH	formaldoxime	ch2noh
834	CH3NO	nitrosomethane	ch3no
835	CNOH3	1,2-oxaziridine	cnoh3
836	HOCHNH	hydroxymethylimine	hochnh
837	CHSNH2	thioformamide	chsnh2
838	NHCHSH	Methanimidothioic acid	nhchsh
839	CH2OOH	CH2OOH radical	ch2ooh
840	CH3OO	methylperoxy radical	ch3oo
841	CH3OO-	methylperoxy anion	ch3oo-
842	CH3OO+	methylperoxy cation	ch3oo+
843	C2H4O+	ethylene oxide cation	c2h4o+
844	CH2CHOH	ethenol	ch2choh
845	CH3CHO+	acetaldehyde cation	ch3cho+
846	H2COCH2+	Methyl, (methyleneoxoniumyl)-	h2coch2+
847	CH2CHSH	Ethenethiol	ch2chsh
848	H2CONH2+	protonated formamide	h2conh2+
849	NH2CHOH+	Formamide, O-protonated	nh2choh+
850	NH3CHO+	Formamide, N-Protonated	nh3cho+
851	CH2(OH)2	methanediol	ch2o2h2
852	CH3OOH	Methyl peroxide	ch3ooh
853	CH3SSH	Hydrogen methyl disulfide	ch3ssh
854	HSCH2SH	Methanedithiol	ch4s2
855	H2OH2CO	water formaldehyde dimer	h2oh2co
856	C2H4OH+	ethylene oxide, protonated	c2h4oh+
857	CH2CH2OH	2-hydroxy ethyl radical	ch2ch2oh
858	CH3CH2O	Ethoxy radical	ethoxy
859	CH3CHOH	1-hydroxy-ethyl radical	ch3choh
860	CH3CHOH+	acetaldehyde, protonated	ch3choh+
861	CH3OCH2	methoxymethyl radical	ch3och2
862	NH2CH2OH	aminomethanol	nh2ch2oh
863	CH3SCH3+	dimethyl sulfide cation	mesme+
864	CH3SeCH3	dimethylselenide	dmse
865	CH3OHH2O	methanol water dimer	ch3ohh2o
866	H2OCH3OH	water methanol dimer	h2och3oh
867	CuF2	Copper difluoride	cuf2
868	ZnF2	Zinc difluoride	znf2
869	CNF	iso cyanogen fluoride	cnf
870	FCN	Cyanogen fluoride	fcn
871	BrCN	Cyanogen bromide	brcn
872	ICN	Cyanogen iodide	icn
873	FBO	Boron monofluoride monoxide	fbo
874	BeF2	Beryllium fluoride	bef2
875	MgF2	Magnesium fluoride	mgf2
876	BeCl2	Beryllium chloride	becl2
877	MgCl2	Magnesium dichloride	mgcl2
878	CaCl2	Calcium Chloride	cacl2
879	ZnCl2	Zinc dichloride	zncl2
880	BeBr2	Beryllium bromide	bebr2
881	CaBr2	Calcium dibromide	cabr2
882	CaF2	Calcium difluoride	caf2
883	FCO	Carbonyl fluoride	fco
884	FCO+	Carbonyl fluoride cation	fco+
885	ClCO	carbonyl monochloride	clco
886	BF2	Boron difluoride radical	bf2
887	FNS	Thionitrosyl fluoride	fns
888	FSN	Thiazyl fluoride	fsn
889	OPCl	Phosphorus oxychloride	opcl
890	BrNO	Nitrosyl bromide	brno
891	INO	Nitrosyl iodide	ino
892	CF2-	Difluoromethylene anion	cf2-
893	CF2+	Difluoromethylene cation	cf2+
894	CFCl	chlorofluoromethylene	cfcl
895	SiF2	Silicon difluoride	sif2
896	SiF2+	Silicon difluoride cation	sif2+
897	CCl2-	dichloromethylene anion	ccl2-
898	CCl2+	dichloromethylene cation	ccl2+
899	GeF2	Germanium difluoride	gef2
900	GeCl2	Germanium dichloride	gecl2
901	CBr2	dibromomethylene	cbr2
902	FOO+	Fluorine dioxide cation	foo+
903	ClOO+	chloroperoxy cation	cloo+
904	OClO-	Chlorine dioxide anion	oclo-
905	OClO+	Chlorine dioxide cation	oclo+
906	ClSO	Sulfur chloride oxide	clso
907	BrOO	Bromine dioxide	broo
908	OBrO	Bromine dioxide radical	obro
909	NF2+	Difluoroamino cation	nf2+
910	PF2	Phosphorus difluoride	pf2
911	PF2+	Phosphorus difluoride cation	pf2+
912	FClO	chlorosyl fluoride	fclo
913	ClOF	Chlorine hypofluorite	clof
914	SF2	sulfur difluoride	sf2
915	SF2-	sulfur difluoride anion	sf2-
916	SF2+	sulfur difluoride cation	sf2+
917	SCl2	Sulfur dichloride	scl2
918	SeF2	Selenium difluoride	sef2
919	BrOCl	Bromine hypochlorite	brocl
920	SeCl2	Selenium Dichloride	secl2
921	SBr2	Sulfur dibromide	sbr2
922	SeBr2	Selenium dibromide	sebr2
923	BrOBr	Bromine oxide	brobr
924	F3-	trifluoride anion	f3-
925	Cl3-	trichloride anion	cl3-
926	Br3-	tribromide anion	br3-
927	I3-	triiodide	i3-
928	SFCl	Sulfur chloride fluoride	sfcl
929	HCCF	Fluoroacetylene	hccf
930	HCCF+	fluoroacetylene cation	hccf+
931	HCCCl	Chloroacetylene	hcccl
932	HCCBr	bromoacetylene	hccbr
933	HFCO	formyl fluoride	hfco
934	HFCO+	formyl fluoride cation	hfco+
935	COHCl	Formyl chloride	cohcl
936	COHBr	Formyl bromide	cohbr
937	CHCl2	dichloromethyl radical	chcl2
938	CHF2	difluoromethyl radical	chf2
939	CHF2+	difluoromethyl cation	chf2+
940	CHFCl	Chlorofluoromethyl radical	chfcl
941	CHFCl+	Chlorofluoromethyl cation	chfcl+
942	CHCl2+	dichloromethyl cation	chcl2+
943	CHBr2	dibromomethyl radical	chbr2
944	HOClO	Chlorous acid	hoclo
945	NHF2	difluoramine	nhf2
946	NHCl2	dichloroamine	nhcl2
947	CH2FCl	fluorochloromethane	ch2fcl
948	SiH2F2	difluorosilane	sih2f2
949	CH2BrF	Methane, bromofluoro-	ch2fbr
950	CH2BrCl	Methane, bromochloro-	ch2clbr
951	CH2FI	fluoroiodomethane	ch2fi
952	CH2Br2	dibromomethane	ch2br2
953	CH2ClI	chloroiodomethane	ch2cli
954	CH2BrI	bromoiodomethane	ch2bri
955	CH2I2	Diiodomethane	ch2i2
956	SiH2Cl2	dichlorosilane	sih2cl2
957	CH3MgBr	Methyl Magnesium Bromide	ch3mgbr
958	CH2CHF+	fluoroethene cation	ch2chf+
959	C2H3Br	vinyl bromide	c2h3br
960	C2H3I	Vinyl iodide	c2h3i
961	CH2FOH	fluoromethanol	ch2foh
962	CH3OCl	methyl hypochlorite	ch3ocl
963	CH2CH2Cl	2-chloroethyl radical	ch2ch2cl
964	CHClCH3	1-chloroethyl radical	chclch3
965	C2H5F	fluoroethane	c2h5f
966	CH3SiFH2	fluoromethylsilane	ch3sifh2
967	C2H5Br	Ethyl bromide	etbr
968	C2H5I	Ethyl iodide	c2h5i
969	KrF2	Krypton difluoride	krf2
970	XeF2	Xenon difluoride	xef2
971	B4H10	Tetraborane(10)	b4h10
972	C4	Carbon tetramer	c4
973	C4+	Carbon tetramer cation	c4+
974	C4H2	Diacetylene	c4h2
975	C4H2+	diacetlyene cation	c4h2+
976	C2H3CCH	1-Buten-3-yne	c2h3cch
977	C4H4	cyclobutadiene	cbd
978	C4H4	Tetrahedrane	c4h4
979	H2CCCCH2	Butatriene	h2cccch2
980	CHCCH2CH3	1-Butyne	c107006
981	CH3CHCHCH2	methylallyl radical	c4h7
982	C4H8	methylcyclopropane	mcp
983	CH2CHCH2CH3	1-Butene	bute1
984	B(CH3)3	trimethylborane	bme3
985	Al(CH3)3	trimethyl aluminum	tma
986	SiH(CH3)3	trimethylsilane	trimsi
987	Li3N	trilithium nitride	li3n
988	C2N2+	Cyanogen cation	c2n2+
989	As4	Arsenic tetramer	as4
990	HCCCN	Cyanoacetylene	hcccn
991	HCCCN+	Cyanoacetylene cation	hcccn+
992	H2CNCN	cyanamide, methylene	ch2ncn
993	HNCCNH	Ethenediimine	hnccnh
994	C3H3N+	acrylonitrile cation	ch2chcn+
995	CH3N3	methyl azide	ch3n3
996	NH2CCNH2	Diaminoacetylene	daa
997	NH2CH2CN	Aminoacetonitrile	aan
998	CH3NHN2+	methyl azide, protonated	ch3nhn2+
999	C2H5CN	ethyl cyanide	c2h5cn
1000	CH5N3	Guanidine	guanidine
1001	C4H6	Bicyclo[1.1.0]butane	c157335
1002	CH3NNCH3	(Z)-1,2-Dimethyldiazene	dmdiazz
1003	H2NCHCHNH2	diaminoethylene	dae
1004	CH6N3+	guanidinium	ch6n3+
1005	CH7N3	triaminomethane	tam
1006	C3H7N	Azetidine	azet
1007	CH3NHNHCH3	dimethyl hydrazine	dmh
1008	P(CH3)3	trimethylphosphine	tmp
1009	N(SiH3)3	trisilylamine	tsa
1010	As(CH3)3	trimethyl arsine	tmas
1011	(CH3)3NH+	protonated trimethyl amine	ptma
1012	C3H7NH3+	n-propylamine, protonated	c3h7nh2
1013	Li2O2	dilithium dioxide	li2o2
1014	Na2O2	disodium dioxide	na2o2
1015	K2O2	dipotassium dioxide	k2o2
1016	C3O	Tricarbon monoxide	c3o
1017	ONNO	NO dimer	onno
1018	S2N2	Disulfur dinitride	s2n2
1019	CO3	Carbon trioxide	co3
1020	CO3--	carbonate	co3--
1021	CS3--	Carbonotrithioate	cs3--
1022	NO3	Nitrogen trioxide	no3
1023	NO3-	nitrate anion	no3-
1024	NO3+	nitrogen trioxide cation	no3+
1025	SO3-	Sulfur trioxide anion	so3-
1026	SO3--	Sulfate dianion	so3--
1027	SO3+	Sulfur trioxide cation	so3+
1028	SeO3	selenium trioxide	seo3
1029	S4	Sulfur tetramer	s4
1030	TeO3	Tellurium trioxide	teo3
1031	HCO3-	bicarbonate anion	hco3-
1032	HSO3	Hydroxysulfonyl radical	hso3
1033	NH2NO2	nitramide	nh2no2
1034	C2H2CO	cyclopropenone	c2h2co
1035	C3H2O	Propadienal	c3h2o
1036	HCCCHO	2-propynal	hcccho
1037	C2H2O2+	Ethanedial cation	c2h2o2+
1038	H2CO3	Carbonic acid	h2co3
1039	H2CS3	thiocarbonic acid	h2cs3
1040	H2NO3+	Nitric Acid, Protonated	h2no3+
1041	H2SO3	Sulfurous acid	h2so3
1042	C2H3NO	Nitrosoethylene	c2h3no
1043	CH3NCO	methylisocyante	ch3nco
1044	HOCH2CN	cyanomethanol	hoch2cn
1045	CH3COO-	acetate anion	ch3coo-
1046	NH2COOH	Carbamic acid	nh2cooh
1047	H3BO3	Boric acid	h3bo3
1048	H3AlO3	Aluminum hydroxide	h3alo3
1049	H3CO3+	carbonic acid, protonated	h3co3+
1050	C3H4O	2-Propyn-1-ol	c107197
1051	C3H4O	allenol	c9000071
1052	C3H4O	Methylketene	c6004440
1053	CH2CHCHO	Acrolein	c3h4o
1054	NH2CONH2+	Urea cation	urea+
1055	C2H4O2	1,3-dioxetane	c2h4o2
1056	CHOCH2OH	hydroxy acetaldehyde	haa
1057	NH2COOH2+	Carbamic acid, O-protonated	nh2cooh2+
1058	NH3COOH+	protonated Carbamic acid	nh3cooh+
1059	H2OHCOOH	Water formic acid dimer 1	h2ohcooh_10
1060	H2OHCOOH	Water formic acid dimer 2	h2ohcooh_11
1061	HCOOHH2O	Formic acid water dimer	hcoohh2o
1062	HOCH2OOH	hydroxy methyl peroxide	hoch2ooh
1063	CH3COCH2	Acetonyl radical	ch3coch2
1064	CH2C(OH)NH2	1-amino vinyl alchohol	ava
1065	CH3C(OH)=NH	Ethaninidic acid	eia
1066	HCONHCH3	N-methylformamide	nmfa
1067	CH3CSNH2	Ethanethioamide	ch3csnh2
1068	CH5N2O+	urea, N-protonated	ch4n2o+
1069	H2NCOHNH2+	urea, protonated	ureah+
1070	C2H5OO	ethylperoxy radical	c2h5oo
1071	CH3NNCH3	(E)-1,2-Dimethyldiazene	dmdiaze
1072	C3H5OH	Cyclopropanol	cproh
1073	C3H6O	2-Propen-1-ol	c107186
1074	C3H6O	Acetone enol	enol
1075	C3H6O	Oxetane	oxetane
1076	CH3COCH3-	acetone anion	ch3coch3-
1077	CH3CSCH3	Thioacetone	ch3csch3
1078	CH3OOCH3	dimethylperoxide	dmp
1079	CH3COHCH3+	acetone, protonated	acetoneh+
1080	HOCH2CH2NH2	monoethanolamine	mea
1081	C3H7OH	1-Propanol	proh
1082	H2OCH3OCH3	water dimethylether dimer	h2och3och3
1083	Li2F2	Lithium fluoride dimer	li2f2
1084	Na2F2	Sodium Fluoride Dimer	na2f2
1085	Na2Cl2	Disodium dichloride	na2cl2
1086	C2F2	difluoroacetylene	c2f2
1087	C2Cl2	dichloroacetylene	c2cl2
1088	C2Cl2+	dichloroacetylene cation	c2cl2+
1089	FNO2	Nitryl fluoride	fno2
1090	FONO	Nitrosyl hypofluorite	fono
1091	ClONO	chlorine nitrite	clono
1092	BrONO	Bromine nitrite	brono
1093	CF2O+	Carbonic difluoride cation	f2co+
1094	COFCl	Carbonic chloride fluoride	cofcl
1095	Cl2CS	Thiophosgene	cl2cs
1096	COBr2	Carbonic dibromide	cobr2
1097	BF3-	Borane, trifluoro- anion	bf3-
1098	BF3+	boron trifluoride cation	bf3+
1099	BClF2	Chlorodifluoroborane	bclf2
1100	ScF3	Scandium trifluoride	ScF3
1101	BCl3+	Boron Trichloride cation	bcl3+
1102	GaF3	Gallium trifluoride	gaf3
1103	GaCl3	Gallium trichloride	gacl3
1104	BBr3	Boron tribromide	bbr3
1105	AlBr3	Aluminum Bromide	albr3
1106	ClO3	Chlorine trioxide	clo3
1107	ClO3-	chlorate anion	clo3-
1108	BrO3-	Bromate anion	bro3-
1109	CF3-	Trifluoromethyl anion	cf3-
1110	CF3+	Trifluoromethyl cation	cf3+
1111	CF2Cl	difluorochloromethyl radical	cf2cl
1112	SiF3	Silicon trifluoride radical	sif3
1113	SiF3+	Silicon trifluoride cation	sif3+
1114	CFCl2	dichlorofluoromethyl radical	cfcl2
1115	CCl3-	Trichloromethyl anion	ccl3-
1116	CCl3+	Trichloromethyl cation	ccl3+
1117	SiCl3	trichlorosilyl radical	sicl3
1118	SiCl3+	trichlorosilyl cation	sicl3+
1119	CBr3	tribromomethyl radical	cbr3
1120	FOOF	Perfluoroperoxide	foof
1121	ClO2F	Chloryl fluoride	clo2f
1122	F2SO	Thionyl Fluoride	f2so
1123	ClOOCl	Dichlorine dioxide	cloocl
1124	FSSF	Difluorodisulfane	fssf
1125	S2F2	Thio-thionyl fluoride	s2f2
1126	SOCl2	thionyl chloride	socl2
1127	SSCl2	Thiothionyl chloride	sscl2
1128	SeOCl2	selenium oxychloride	seocl2
1129	NF3-	Nitrogen trifluoride anion	nf3-
1130	NF3+	Nitrogen trifluoride cation	nf3+
1131	NCl3	nitrogen trichloride	ncl3
1132	AsF3	Arsenic trifluoride	asf3
1133	SbF3	Antimony Trifluoride	sbf3
1134	AsCl3	Arsenous trichloride	ascl3
1135	SbCl3	Antimony Trichloride	sbcl3
1136	NBr3	Nitrogen Tribromide	nbr3
1137	PBr3	Phosphorus tribromide	pbr3
1138	AsBr3	Arsenic tribromide	asbr3
1139	NI3	Nitrogen triiodide	ni3
1140	PI3	Phosphorus triiodide	pi3
1141	ClSSCl	Disulfur dichloride	s2cl2
1142	SF3	Sulfur trifluoride	sf3
1143	ClF3	Chlorine trifluoride	clf3
1144	BrF3	Bromine trifluoride	brf3
1145	IF3	iodone trifluoride	if3
1146	HClO3	Chloric Acid	hclo3
1147	CHF2Cl	difluorochloromethane	chf2cl
1148	SiHF3	trifluorosilane	sihf3
1149	CHFCl2	fluorodichloromethane	chfcl2
1150	CDCl3	trichloromethane-d	cdcl3
1151	CHBrF2	Methane, bromodifluoro-	chbrf2
1152	CHFClBr	fluorochlorobromomethane	chfclbr
1153	CHBrCl2	Methane, bromodichloro-	chbrcl2
1154	CHF2I	difluoroiodomethane	chf2i
1155	CHBr2F	dibromofluoromethane	chbr2f
1156	CHFClI	fluorochloroiodomethane	chfcli
1157	CHCl2I	dichloroiodomethane	chcl2i
1158	CHClBr2	Methane, dibromochloro-	chclbr2
1159	CHBr3	bromoform	chbr3
1160	CHI3	Iodoform	chi3
1161	NF3H+	protonated nitrogen trifluoride	nf3h+
1162	AsF3H+	Arsenic trifluoride, protonated	asf3h+
1163	C2H2F2	Ethene, 1,2-difluoro-, (E)-	c2h2f2e
1164	C2H2F2	Ethene, 1,2-difluoro-, (Z)-	c2h2f2z
1165	C2H2ClF	1-chloro-1-fluoroethylene	c2h2clf
1166	CHFCHCl	(E)-1-chloro-2-fluoroethene	chfchcle
1167	CHFCHClz	(Z)-1-Chloro-2-fluoroethene	chfchclz
1168	C2H2Br2	1,1-dibromoethene	c2h2br2
1169	CHBrCHBr	Ethene, 1,2-dibromo-, (E)-	chbrchbre
1170	CHBrCHBr	Ethene, 1,2-dibromo-, (Z)-	chbrchbrz
1171	CH2FCHO	Fluoroacetaldehyde	ch2fcho
1172	CH2ClCHO	chloroacetaldehyde	ch2clcho
1173	C2H4F2	1,2-difluoroethane	c2h4f2
1174	CH2FCH2Cl	Ethane, 1-chloro-2-fluoro-	ch2fch2cl
1175	CH2BrCH2Cl	1-bromo-2-chloroethane	ch2brch2cl
1176	CH2BrCH2Br	Ethane, 1,2-dibromo-	ch2brch2br
1177	CH2CFCH3	2-fluoropropene	2fpro
1178	CH2CHCH2F	Allyl Fluoride	allylf
1179	CH3CHCHF	trans-1-Fluoro-1-propene	propene1ft
1180	C3H5Cl	1-Propene, 3-chloro-	prop1cl3
1181	C3H5Cl	1-chloro-1-propene(E)	prop1cl1e
1182	C3H5Cl	1-chloro-1-propene(Z)	prop1cl1z
1183	CH2FCH2OH	2-fluoroethanol	ch2fch2oh
1184	CH2ClCH2OH	2-Chloroethanol	ch2clch2oh
1185	CH2ClCH2OH2+	2-chloroethanol, protonated	ch2clch2oh2+
1186	CH2FCH2CH3	1-Fluoropropane	prf1
1187	CH3CHFCH3	2-Fluoropropane	prf2
1188	CH2ClCH2CH3	Propane, 1-chloro-	prcl1
1189	CH3CHClCH3	Propane, 2-chloro-	prcl2
1190	CH3CH2CH2Br	n-propyl bromide	prbr
1191	CH3CHBrCH3	i-propyl bromide	iprbr
1192	C3H9O+	trimethyl oxonium cation	c3h9o+
1193	B5H9	pentaborane9	b5h9
1194	C5H4	pentatetraene	ptrene
1195	C5H5	cyclopentadienyl radical	c5h5
1196	C5H5-	cylopentadienyl anion	c5h5-
1197	C5H6	Propellane	propellane
1198	C5H7	1,3-pentadienyl radical	pdyl
1199	C5H7	cyclopentenyl radical	cpyl
1200	C5H8	1-pentyne	a1pentyne
1201	C5H8	Bicyclo[1.1.1]pentane	bcp
1202	C5H8	Ethenylcyclopropane	c693867
1203	CH3CCCH2CH3	2-Pentyne	2pentyne
1204	CH2CHCH2CH2CH3	1-pentene	pentene
1205	Si(CH3)4	tetramethylsilane	tms
1206	CH2N4	1H-Tetrazole	1htz
1207	C3H3N2	imidazolyl radical	im
1208	C3H3N2-	imidizolyl anion	im-
1209	C2H3N3	1H-1,2,4-Triazole	c288880
1210	C4H4N	pyrrolide radical	c4h4n
1211	C4H4N-	pyrrolide anion	c4h4n-
1212	C3H4N2	2H-Imidazole	imid2h
1213	C3H4N2	4H-Imidazole	imid4h
1214	C4H5N	2H-pyrrole	pyrrole2
1215	C4H5N	3H-pyrrole	pyrrole3
1216	CH2CHCH2CN	Allylcyanide	ch2chch2cn
1217	C4H6N+	pyrrole, alpha-protonated	appyr
1218	C4H6N+	pyrrole, beta-protonated	bppyr
1219	C4H6N+	pyrrole, protonated	ppyr
1220	CH3CH(CH3)CN	Propanenitrile, 2-methyl-	c4h7n
1221	CH3CH2CH2CN	Butanenitrile	c109740
1222	C(NH2)H2CH2CH2CH3	1-Butanamine	butam1
1223	NH(C2H5)2	diethylamine	dea
1224	NC4H12+	tetramethyl ammonium cation	nc4h12+
1225	C3O2+	Carbon suboxide cation	c3o2+
1226	B2O3	diboron trioxide	b2o3
1227	MgCO3	Magnesium Carbonate	mgco3
1228	BeCO3	Beryllium Carbonate	beco3
1229	CaCO3	Calcium Carbonate	caco3
1230	ONONO	Nitrosyl nitrite	onono
1231	PO4---	phosphate	po4---
1232	SO4--	sulfate	so4--
1233	HOONO2	peroxy nitric acid	hoono2
1234	HSO4-	bisulfate anion	hso4-
1235	C2H2N2S	1,3,4-Thiadiazole	c2h2n2s
1236	C3H2O2	Propiolic acid	c3h2o2
1237	CHOCOOH	oxo acetic acid	oaa
1238	CHOOCHO	diformyl ether	choocho
1239	H2SeO4	Selenic acid	h2seo4
1240	C3H3NO	Oxazole	oxazole
1241	C3H3NS	Thiazole	thiazole
1242	CH3C(O)OO	acetyl peroxy radical	ch3coo2
1243	H3PO4	Phosphoric Acid	h3po4
1244	C4H4O+	Furan cation	furan+
1245	CH3COCCH	3-butyn-2-one	c1423605
1246	C4H4Se	selenophene	c4h4se
1247	C3H4O2	Methyl glyoxal	megly
1248	C3H4O2	propanedial	propanedial
1249	C3H4O2	propenalol	propenalol
1250	HOCHCCHOH	allenediol	aldiol
1251	C2H4O3	1,2,3-trioxolane	c2h4o3
1252	C2H4O3	trioxolane124	triox
1253	HOCH2COOH	Hydroxyacetic acid	hac
1254	H2NCH2COOH	Glycine	glycine
1255	CH3SO2NH2	methanesulfonamide	ch3so2nh2
1256	C4H6O	cis-2-butenal	butenal2c
1257	C4H6O	Furan, 2,5-dihydro-	furan25h
1258	CH3CH2COOH	Propanoic Acid	propanoic
1259	HCOOC2H5	Ethyl formate	faee
1260	CH3SSSCH3	dimethyl trisulfide	c2h6s3
1261	C3H7NO	dimethylformamide	dmf
1262	C4H8O	Furan, tetrahydro-	thf
1263	C3H8O2	1,3-Propanediol	c504632
1264	C4H10O	1-Butanol	butanol1
1265	C4H10O	1-Propanol, 2-methyl-	c78831
1266	C4H10O	Methyl propyl ether	meopr
1267	C4H10O+	1-Butanol cation	butanol1+
1268	C4H9SH	1-Butanethiol	bush
1269	ClONO2	Chlorine nitrate	clono2
1270	BrONO2	Bromine nitrate	brono2
1271	TiCl4	Titanium tetrachloride	ticl4
1272	ClO4-	perchlorate anion	clo4-
1273	BF4-	tetrafluoroboron anion	bf4-
1274	SO2F2	Sulfuryl fluoride	so2f2
1275	TiF4	Titanium tetrafluoride	tif4
1276	CF3Br	Bromotrifluoromethane	cf3br
1277	GeF4	Germanium tetrafluoride	gef4
1278	CCl4+	Carbon tetrachloride cation	ccl4+
1279	CBrClF2	Methane, bromochlorodifluoro-	cbrclf2
1280	CBrCl2F	bromodichlorofluoromethane	cbrcl2f
1281	CF3I	trifluoroiodomethane	cf3i
1282	CBrCl3	Methane, bromotrichloro-	cbrcl3
1283	CBr2F2	Methane, dibromodifluoro-	cbr2f2
1284	GeCl4	Germanium Tetrachloride	gecl4
1285	CBr2ClF	dibromochlorofluoromethane	cbr2clf
1286	CBr2Cl2	dibromodichloromethane	cbr2cl2
1287	CCl3I	trichloroiodomethane	ccl3i
1288	CFBr3	fluorotribromomethane	cfbr3
1289	CFClBrI	fluorochlorobromoiodomethane	cfclbri
1290	CBr3Cl	tribromochloromethane	cbr3cl
1291	CF2I2	difluorodiiodomethane	cf2i2
1292	CBr4	Carbon tetrabromide	cbr4
1293	CCl2I2	dichlorodiiodomethane	ccl2i2
1294	SiBr4	Silicon tetrabromide	sibr4
1295	CBr3I	tribromoiododmethane	cbr3i
1296	GeBr4	Germanium tetrabromide	gebr4
1297	CI4	tetraiodomethane	ci4
1298	SiI4	silicon tetraiodide	sii4
1299	ClOF3	Chlorine trifluoride oxide	clof3
1300	SF4	Sulfur tetrafluoride	sf4
1301	SeF4	Selenium tetrafluoride	sef4
1302	SCl4	Sulfur tetrachloride	scl4
1303	C2HF3	Trifluoroethylene	c2hf3
1304	C2HF3+	Trifluoroethylene cation	c2hf3+
1305	CHBrCF2	1-Bromo-2,2-difluoroethylene	chbrcf2
1306	HClO4	perchloric acid	hclo4
1307	CF3OH	trifluoromethanol	cf3oh
1308	CH2ClCCCl	1,3-dichloropropyne	ch2clcccl
1309	CHClCCHCl	1,3-dichloroallene	chclcchcl
1310	CHCl2CCH	3,3-dichloropropyne	chcl2cch
1311	CHCl2CHO	dichloroacetaldehyde	chcl2cho
1312	PF3CH2	phosphorane, trifluoromethylene-	pf3ch2
1313	CHF2CH2F	Ethane, 1,1,2-trifluoro	ch2fchf2
1314	CH3CF2Cl	1-Chloro-1,1-Difluoroethane	ch3cf2cl
1315	CH3CFCl2	1,1-Dichloro-1-fluoroethane	ch3cfcl2
1316	CH2ClCHCl2	1,1,2-trichloroethane	ch2clchcl2
1317	SiCl3CH3	methyltrichlorosilane	sicl3ch3
1318	CH3CBr3	1,1,1-tribromoethane	ch3cbr3
1319	NH3BCl3	Amminetrichloroboron	nh3bcl3
1320	SiH3CCl3	(trichloromethyl)silane	sih3ccl3
1321	CH2CClCHCH2	1,3-Butadiene, 2-chloro-	c4h5cl
1322	CH2FCH2CH2F	1,3-difluoropropane	ch2fch2ch2f
1323	CH3CF2CH3	2,2-difluoropropane	ch3cf2ch3
1324	CH2ClCH2CH2Cl	1,3-dichloropropane	prdicl13
1325	CHCl2CH2CH3	1,1-dichloropropane	prdicl11
1326	SiCl2(CH3)2	dichlorodimethylsilane	sicl2me2
1327	CH2ClCHCHCH3	2-Butene, 1-chloro-	bute2cl1
1328	C4H9F	1-fluorobutane	butaf1
1329	CH3CHFCH2CH3	2-fluorobutane	butaf2
1330	XeF4	Xenon tetrafluoride	xef4
1331	C2H2N2O	Furazan	furazan
1332	CF3PH2	phosphine, (trifluoromethyl)-	cf3ph2
1333	NH3BF3	Amminetrifluoroboron	nh3bf3
1334	C6H2	hexatriyne	c6h2
1335	C6H4	Benzyne	benzyne
1336	C6H5	phenyl	phenyl
1337	C6H5-	phenyl anion	phenyl-
1338	C6H6	Prismane	prismane
1339	C6H6	1,2,4,5-Hexatetraene	ht1245
1340	C6H6	3,4-Dimethylenecyclobutene	cb34m
1341	C6H6	Benzvalene	bv
1342	C6H6	Dewar Benzene	dewar
1343	C6H6	Hexa-1,5-diene-3-yne	hdy153
1344	C6H6	Trimethylenecycopropane	tmcp
1345	C6H6+	Benzene cation	c6h6+
1346	C6H7+	benzene, protonated	c6h7+
1347	C6H8	1,3-Cyclohexadiene	cyhexadiene13
1348	C6H10	1,5-Hexadiene	c592427
1349	C6H10	2,4-Hexadiene, (E,Z)-	hexdi24ez
1350	C6H10	cyclohexene	cyclohexene
1351	C4H6(CH3)2	1,1-dimethylcyclobutane	dmcb11
1352	C6H12	(1R,2R)-1,2-dimethylcyclobutane	dmcb12t
1353	C6H12	(1r,3r)-1,3-dimethylcyclobutane	dmcb13t
1354	C6H12	(E)-2-Hexene	e2hexene
1355	C6H12	(E)-hex-3-ene	e3hexene
1356	C6H12	(Z)-hex-2-ene	z2hexene
1357	C6H12	(Z)-hex-3-ene	z3hexene
1358	C6H12	2,3-dimethylbut-1-ene	c563780
1359	C6H12	2,3-dimethyl-but-2-ene	tmeet
1360	C6H12	cis-1,2-dimethylcyclobutane	dmcb12c
1361	C6H12	cis-1,3-dimethylcyclobutane	dmcb13c
1362	N3P3	1,3,5,2,4,6-Triazatriphosphorine	n3p3
1363	C4H2N2	Fumaronitrile	c4h2n2
1364	C2H2N4	sym-tetrazine	ttz
1365	C5H5N	E-2,4-pentadienenitrile	bdcn
1366	B3N3H6	borazine	borazine
1367	C5H6N+	Pyridinium	c5h6n
1368	C5H7N	Cyclobutanecarbonitrile	c4426113
1369	C6H10	Bicyclo[3.1.0]hexane	c285585
1370	Li2CO3	Lithium Carbonate	li2co3
1371	Na2CO3	Sodium Carbonate	na2co3
1372	C2O4--	oxalate anion	c2o4
1373	MgSO4	Magnesium Sulfate	mgso4
1374	C3H2O3	vinylene carbonate	vica
1375	C2H2O4	Oxalic Acid	oxalic
1376	C4H4O2	2(5H)-Furanone	furanone
1377	C2H4N2S2	Ethanedithioamide	c79403
1378	C2H4CO3	Ethylene carbonate	etco3
1379	C2H4O4	Formic acid dimer	fadimer
1380	C2H5NO3	Nitric acid, ethyl ester	c625581
1381	C5H6O	2H-Pyran	pyran2
1382	C5H6O	2-methylfuran	furan2m
1383	C5H6O	3-Methylfuran	furan3m
1384	C5H6O	Pentadienal	pdal
1385	C4H6O2	γ–Butyrolactone	c96480
1386	C4H6O2	2,3-Butanedione	c431038
1387	C4H6O2	Crotonic Acid	crot
1388	C4H6OS	2,3-dihydrothiophene-2-ol	c9000117
1389	C4H6OS	2,5-dihydrothiophene-3-ol	c9000093
1390	C4H6OS	4,5-dihydrothiophene-2-ol	c9000106
1391	C4H6OS	4,5-dihydrothiophene-3-ol	c9000082
1392	C4H6OS	Vinyl sulfoxide	c1115157
1393	C3H6S3	1,3,5-Trithiane	c3h6s3
1394	C4H7NO	Ethoxyacetonitrile	etoaccn
1395	HCONH2CN2H4	formamide aminomethanimine dimer	d13
1396	C3H7ONO	Propyl nitrite	prono
1397	CH3CH(NH2)COOH	Alanine	alanine
1398	CH3NHCH2COOH	Sarcosine	sarcosine
1399	NH2CH2CH2COOH	β–alanine	betaalanine
1400	C5H8O	Cyclopentanone	c120923
1401	C5H8O	Methyl cyclopropyl ketone	c765435
1402	NH(CH3)CONH(CH3)	Urea, N,N'-dimethyl-	c96311
1403	C4H8O2	1,3-Dioxane	dioxan13
1404	C4H8O2	Ethyl acetate	c141786
1405	C5H10O	2-methylbutyraldehyde	2meba
1406	C5H10O	Pentanal	pal
1407	C5H12O	3-Pentanol	pentan3ol
1408	C5H12S	2-Butanethiol, 2-methyl-	c1679090
1409	C4F2	difluorobutadiyne	c4f2
1410	ClCOClCO	Oxalyl chloride	oxcl
1411	CF3CN+	Acetonitrile, trifluoro- cation	cf3cn+
1412	C2F4+	Tetrafluoroethylene cation	c2f4+
1413	C2ClF3	Ethene, chlorotrifluoro-	c2f3cl
1414	CF2CCl2	difluorodichloroethylene	cf2ccl2
1415	CFClCClF	trans-1,2-dichloro-1,2-difluoroethylene	cfclcclf
1416	CFClCFCl	cis-1,2-dichloro-1,2-difluoroethylene	cfclcfcl
1417	C2FCl3	fluorotrichloroethene	c2fcl3
1418	C2Br4	tetrabromoethene	c2br4
1419	CF3OF	Trifluoromethylhypofluorite	cf3of
1420	SiF5-	silicon pentafluoride anion	sif5-
1421	SOF4	Sulfur tetrafluoride oxide	sof4
1422	AsF5	Arsenic pentafluoride	asf5
1423	SF5	Sulfur pentafluoride	sf5
1424	SF5+	pentafluoro sulfur cation	sf5+
1425	SbCl5	Antimony pentachloride	sbcl5
1426	BrF5	bromine pentafluoride	brf5
1427	ClF5	chlorinepentafluoride	clf5
1428	IF5	pentafluoroiodine	if5
1429	CF3CHO	trifluoroacetaldehyde	cf3cho
1430	CCl3CHO	trichloroacetaldehyde	ccl3cho
1431	CHFClCHClF	ethane, 1,2-dichloro-1,2-difluoro-	chfclchclf
1432	CF3CH2F	1,1,1,2-tetrafluoroethane	cf3ch2f
1433	CHF2CHF2	1,1,2,2-tetrafluoroethane	chf2chf2
1434	CF3CH2Cl	2,2,2-Trifluoroethyl chloride	cf3ch2cl
1435	CHFClCHFCl	1,2-dichloro-1,2-difluoroethane RR	chfclchfcl
1436	CH2ClCCl3	1,1,1,2-tetrachloroethane	ch2clccl3
1437	CHCl2CHCl2	Ethane, 1,1,2,2-tetrachloro-	chcl2chcl2
1438	CH2BrCBr3	1,1,1,2-tetrabromo ethane	c2h2br4
1439	CHCl2CHF2	1,1-dichloro-2,2-difluoroethane	c2h2cl2f2
1440	CF3COOH	trifluoroacetic acid	cf3cooh
1441	C4H3ClO	Furan, 2-chloro	fur2cl
1442	C4H3ClO	Furan,3-chloro	fur3cl
1443	C4H8Cl2	Butane, 2,3-dichloro-, (r*,r*)-(.+/-.)-	c2211678
1444	C4H8O2	Butanoic acid	bua
1445	C6H5CH2	benzyl radical	benzyl
1446	C7H7	cycloheptatrienyl radical	c7h7
1447	C7H7+	cycloheptatrienyl cation	c7h7+
1448	C6H5CH3	toluene	toluene
1449	C7H8	cycloheptatriene	cht
1450	C7H8	Norbornadiene	norbor
1451	C7H8	Quadricyclane	qucy
1452	C7H12	Norbornane	nor
1453	C7H14	cycloheptane	c7h14
1454	C7H16	2-methylhexane	2mhex
1455	C7H16	3-methylhexane	hex3m
1456	C7H16	heptane	heptane
1457	CH(CN)3	tricyanomethane	mecn3
1458	HN=C=C(CN)2	Dicyanoketenimine	c4hn3
1459	C6H7N	2-Methylpyridine	mp
1460	C6H5NH2	aniline	aniline
1461	C6H13N	2-Methylpiperidine	pip2m
1462	C6H13N	cyclohexanamine	cham
1463	C6H15N	triethylamine	tea
1464	N2O5	Dinitrogen pentoxide	n2o5
1465	C4H2O3	Maleic Anhydride	malan
1466	C5H4O2	4-Cyclopentene-1,3-dione	cpdio
1467	C5H4O2	furfural	furfural
1468	C6H5O	phenoxy radical	phenoxy
1469	C5H5NO	2(1H)-Pyridinone	c72762006
1470	C5H5NO	2(3H)-Pyridinone	c9000048
1471	C5H5NO	2(5H)-Pyridinone	c9000037
1472	C5H5NO	2-Pyridinol	c109104
1473	C5H5NO	3(2H)-Pyridinone	c9000004
1474	C5H5NO	3(4H)-Pyridinone	c9000026
1475	C5H5NO	3(6H)-Pyridinone	c9000015
1476	C5H5NO	3-Pyridinol	c109002
1477	C5H5NO	4(1H)-Pryidinone	c9000060
1478	C5H5NO	4(3H)-Pryidinone	c9000059
1479	C5H5NO	4-Pyridinol	c626642
1480	C6H5OH	phenol	phenol
1481	C6H6O	2,4-Cyclohexadienone	c24599573
1482	C6H6O	2,5-Cyclohexadienone	c5664335
1483	C6H5SH	Benzenethiol	phsh
1484	HO2CCHNH2CH2OH	Serine	serine
1485	C5H8O2	Acetylacetone	acac
1486	C4H8O2S	Sulfolane	sulfolane
1487	C7H10	Norbornene	norbornene
1488	CH(C2H3)3	trivinyl methane	tvm
1489	C6H10O	cyclohexanone	chexo
1490	C6H12O	hexanal	c6h12o
1491	C6H12O	Oxepane	oxepane
1492	C3H7OC3H7	di-n-propyl ether	propr
1493	F2CCCF2	tetrafluoroallene	pfa
1494	CF3COO-	trifluoro acetate anion	cf3coo-
1495	CF3COF	trifluoroacetyl fluoride	cf3cof
1496	CF3COCl	trifluoroacetyl chloride	cf3cocl
1497	PF6	Hexafluorophosphate neutral	pf6
1498	PF6-	Hexafluorophosphate ion	pf6-
1499	SF6	Sulfur Hexafluoride	sf6
1500	SeF6	Selenium hexafluoride	sef6
1501	SF5Cl	sulfur chloropentafluoride	sf5cl
1502	CF3CHF2	pentafluoroethane	cf3chf2
1503	CF3CHFCl	1,1,1,2-tetrafluorochloroethane	cf3chfcl
1504	CF3CHCl2	1,1-Dichloro-2,2,2-trifluoroethane	cf3chcl2
1505	CHCl2CClF2	Ethane, 1,2,2-trichloro-1,1-difluoro-	chcl2cclf2
1506	CCl3CHCl2	pentachloroethane	ccl3chcl2
1507	C6H5F	Fluorobenzene	bzf
1508	C6H5Cl	chlorobenzene	bzcl
1509	C6H5Br	bromobenzene	bzbr
1510	C8H6	Calicene	calicene
1511	C6H5CCH	phenylacetylene	phac
1512	C8H6	benzocyclobutadiene	bcbd
1513	C8H6	Pentalene	pentalene
1514	C6H5CHCH2	Styrene	styrene
1515	C8H8	cubane	cubane
1516	C8H8	cyclooctatetraene	cot
1517	C6H5CH2CH3	Ethylbenzene	etbz
1518	CH3C6H4CH3	meta-xylene	mxylene
1519	CH3C6H4CH3	paraxylene	pxylene
1520	C8H14	Bicyclo[2.2.2]octane	bico222
1521	C8H16	cyclooctane	cyclooct
1522	(CH3)3CC(CH3)3	tetramethylbutane	tmb
1523	C8H18	Octane	c8h18
1524	C6H5CN	phenyl cyanide	phcn
1525	C6H12N2	Triethylenediamine	ted
1526	C4O4--	squarate dianion	c4o4--
1527	S4N4	Tetrasulfur tetranitride	s4n4
1528	S8	Octasulfur	s8
1529	C6H4O2	parabenzoquinone	pbq
1530	C4H4N2O2	Uracil	uracil
1531	C6H5CHO	benzaldehyde	benzal
1532	C6H5OCH3	Anisole	anisole
1533	C5H9NO2	Proline	proline
1534	C6H12O2	Methyl pivalate	c598981
1535	C6H12O2	Hexanoic acid	hexa
1536	C4F4	tetrafluorcyclobutadiene	c4f4
1537	Al2Cl6	Aluminum, di-μ-chlorotetrachlorodi-	al2cl6
1538	CF3CF2Cl	pentafluorochloroethane	cf3cf2cl
1539	CF2ClCF2Cl	1,2-Dichloro-1,1,2,2-tetrafluoroethane	cf2clcf2cl
1540	CF3CFCl2	1,1-Dichlorotetrafluoroethane	cf3cfcl2
1541	CF2ClCFCl2	Ethane, 1,1,2-trichloro-1,2,2-trifluoro-	cf2clcfcl2
1542	CF3CCl3	1,1,1-trifluoro-2,2,2-trichloroethane	cf3ccl3
1543	C2Cl6	hexachloroethane	c2cl6
1544	IF7	Iodine heptafluoride	if7
1545	C6H4F2	metadifluorobenzene	mdfb
1546	C6H4F2	orthodifluorobenzene	odfb
1547	C6H4F2	1,4-difluorobenzene	pdfb
1548	C6H4Cl2	1,2-dichlorobenzene	dcb12
1549	C6H4Cl2	1,3-dichlorobenzene	dcb13
1550	C6H4Cl2	1,4-dichlorobenzene	dcb14
1551	C6H5NO	nitrosobenzene	bzno
1552	C9H8	Indene	indene
1553	C9H8	spiro[4.4]nona-1,3,6,8-tetraene	snt
1554	C9H12	n-propyl benzene	prbz
1555	C9H20	Nonane	nonane
1556	C(CN)4	tetracyanomethane	c5n4
1557	C5H4N4	purine	purine
1558	C8H7N	Indole	indole
1559	C3H3N3O3	cyanuric acid	cyanuric
1560	C6H5NO2	Nitrobenzene	c6h5no2
1561	C6H5COOH	benzoic acid	benzo
1562	CH3COC6H5	acetophenone	acph
1563	C3Cl3N3	1,3,5-Triazine, 2,4,6-trichloro-	c3cl3n3
1564	C3F6	hexafluoropropene	c3f6
1565	C6H3F3	Benzene trifluoride 123	bzf3a
1566	C8H18O	1-Octanol	octanol
1567	C10H8	Azulene	azu
1568	C10H8	naphthalene	naph
1569	C10H10	bullvalene	bullv
1570	C10H16	adamantane	adamantane
1571	C6N4	Tetracyanoethylene	tcne
1572	C6N4-	tetracyanoethylene anion	tcne-
1573	C10H22	Decane	decane
1574	C4F6	perfluorobutadiene	c4f6
1575	SF5CF3	Sulfur, pentafluoro(trifluoromethyl)-	sf5cf3
1576	C3F8	perfluoropropane	c3f8
1577	Fe(CO)5	Iron pentacarbonyl	ipc
1578	Fe(C5H5)2	ferrocene	fecp2
1579	B12H12--	Dodecahydrododecaborate(2-)	b12h12--
1580	B12H12--	Dodecahydrododecaborate(2-)	b12h12--
1581	C12H8	Acenaphthylene	acenaph
1582	C12H8	biphenylene	biph
1583	C12H10	biphenyl	biphenyl
1584	C12H10	Heptalene	heptalene
1585	C6H12O6	Inositol	inositol
1586	C6F6	hexafluorobenzene	c6f6
1587	S2F10	disulphur decafluoride	s2f10
1588	C13H10	Fluorene	fluorene
1589	C14H10	Anthracene	anth
1590	C14H10	Phenanthrene	phenanthrene
1591	C14H14	Bibenzyl	bibenzyl
1592	C12H10N2	azobenzene	azobenzene
1593	C6H5COC6H5	benzophenone	benzophenone
1594	C16H10	Pyrene	pyrene
1595	C18H12	Tetracene	tetracene
1596	C19H16	Triphenylmethane	tpm
1597	C24H12	Coronene	coronene
1598	C60	Buckminsterfullerene	c60