National Institute of Standards and Technology

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

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

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

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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	2S	Kh
14	Na-	Sodium atom anion	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	1S	Kh
19	Mg-	Magnesium atom anion	2P	Kh
20	Mg+	Magnesium atom cation	2S	Kh
21	Ca	Calcium atom	1S	Kh
22	B	Boron atom	2P	Kh
23	B-	Boron atom anion	3P	Kh
24	B+	Boron atom cation	1S	Kh
25	Al	Aluminum atom	2P	Kh
26	Al-	Aluminum atom anion	3P	Kh
27	Al+	Aluminum atom cation	1S	Kh
28	BH	Boron monohydride	1Σ	C∞v
29	AlH	aluminum monohydride	1Σ	C∞v
30	BH2	boron dihydride	2A1	C2v
31	AlH2	aluminum dihydride	2A1	C2v
32	BH3	boron trihydride	1A1'	D3h
33	AlH3	aluminum trihydride	1A1'	D3h
34	C	Carbon atom	3P0	Kh
35	C-	Carbon atom anion	4S	Kh
36	C+	Carbon atom cation	2P	Kh
37	Si	Silicon atom	3P	Kh
38	Si-	Silicon atom anion	4S	Kh
39	Si+	Silicon atom cation	2P	Kh
40	CH	Methylidyne	2Π1/2	C∞v
41	SiH	Silylidyne	2Π	C∞v
42	CH2	Methylene	3B1	C2v
43	SiH2	silicon dihydride	1A1	C2v
44	CH3	Methyl radical	2A1	D3h
45	SiH3	Silyl radical	2A1	C3v
46	CH4	Methane	1A1	Td
47	SiH4	Silane	1A1	Td
48	N-	Nitrogen atom anion	3S	Kh
49	N+	Nitrogen atom cation	3P	Kh
50	P	Phosphorus atom	4S	Kh
51	P-	Phosphorus atom anion	3P	Kh
52	P+	Phosphorus atom cation	3P	Kh
53	As	Arsenic atomic	4S	Kh
54	NH	Imidogen	3Σ-	C∞v
55	PH	phosphorus monohydride	3Σ-	C∞v
56	ND2	Amidogen-d2	2B1	C2v
57	NH2	Amino radical	2B1	C2v
58	PH2	Phosphino radical	2B1	C2v
59	ND3	Ammonia-d3	1A1	C3v
60	NH3	Ammonia	1A1	C3v
61	PH3	Phosphine	1A1	C3v
62	O	Oxygen atom	3S	Kh
63	O-	Oxygen atom anion	2P	Kh
64	O+	Oxygen atom cation	4S	Kh
65	S	Sulfur atom	3P	Kh
66	S-	Sulfur atom anion	2P	Kh
67	S+	Sulfur atom cation	4S	Kh
68	Se	Selenium atom	3P	Kh
69	Se-	Selenium atom anion	2P	Kh
70	Se+	Selenium atom cation	4S	Kh
71	DO	Hydroxyl-d	2Π	C∞v
72	OH	Hydroxyl radical	2Π	C∞v
73	DS	Mercapto-d	2Π	C∞v
74	HS	Mercapto radical	2Π	C∞v
75	D2O	Deuterium oxide	1A1	C2v
76	H2O	Water	1A1	C2v
77	HDO	Water-d1	1A1	C2v
78	D2S	Hydrogen sulfide-d2	1A1	C2v
79	H2S	Hydrogen sulfide	1A1	C2v
80	F	Fluorine atom	2P	Kh
81	F-	Fluorine atom anion	1S	Kh
82	F+	Fluorine atom cation	3S	Kh
83	Cl	Chlorine atom	2P	Kh
84	Cl-	Chlorine atom anion	1S	Kh
85	Cl+	Chlorine atom cation	3P	Kh
86	Br	Bromine atom	2P	Kh
87	Br-	Bromine atom anion	1S	Kh
88	Br+	Bromine atom cation	3P	Kh
89	DF	Hydrofluoric acid-d	1Σ	C∞v
90	HF	Hydrogen fluoride	1Σ	C∞v
91	DCl	Hydrochloric acid-d	1Σ	C∞v
92	HCl	Hydrogen chloride	1Σ	C∞v
93	Ne	Neon atom	1S	Kh
94	Ne-	Neon atom anion	2S	Kh
95	Ne+	Neon atom cation	2P	Kh
96	Ar	Argon atom	1S	Kh
97	Ar-	Argon atom anion	2S	Kh
98	Ar+	Argon atom cation	2P	Kh
99	Al2	Aluminum diatomic	3Σg	D∞h
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	C3H6	Cyclopropane	1A1'	D3h
184	CH2CHCH3	Propene	1A'	Cs
185	C3H7	n-Propyl radical	2A"	C1
186	CH3CHCH3	Isopropyl radical	2A	C2
187	C3H8	Propane	1A1	C2v
188	CH3CN	Acetonitrile	1A1	C3v
189	C2H5N	Aziridine	1A'	C1
190	CH3CH2NH2	Ethylamine	1A'	Cs
191	CH3NHCH3	Dimethylamine	1A'	Cs
192	N2O	Nitrous oxide	1Σ	C∞v
193	CO2	Carbon dioxide	1Σg	D∞h
194	OCS	Carbonyl sulfide	1Σ	C∞v
195	SiO2	silicon dioxide	1Σg	D∞h
196	CS2	Carbon disulfide	1Σg	D∞h
197	NO2	Nitrogen dioxide	2A1	C2v
198	PO2	Phosphorus dioxide	2A1	C2v
199	O3	Ozone	1A1	Cs
200	SO2	Sulfur dioxide	1A1	C2v
201	SSO	Disulfur monoxide	1A'	Cs
202	HNCO	Isocyanic acid	1A'	Cs
203	HNO2	Nitrous acid	1A'	Cs
204	CH2CO	Ketene	1A1	C2v
205	HCOOH	Formic acid	1A'	Cs
206	CH3CO	Acetyl radical	2A'	Cs
207	CHONH2	formamide	1A'	Planar
208	C2H4O	Ethylene oxide	1A1	C2v
209	CH3CHO	Acetaldehyde	1A'	Cs
210	C2H4S	Thiirane	1A1	C2v
211	CH3CHS	Thioacetaldehyde	1A'	C1
212	CH3CH2OH	Ethanol	1A'	Cs
213	CH3OCH3	Dimethyl ether	1A1	C2v
214	CH3CH2SH	ethanethiol	1A'	Cs
215	CH3SCH3	Dimethyl sulfide	1A1	C2v
216	ClCN	chlorocyanogen	1Σ	C∞v
217	FNO	Nitrosyl fluoride	1A'	Cs
218	ClNO	Nitrosyl chloride	1A'	Cs
219	CF2	Difluoromethylene	1A1	D∞h
220	CCl2	dichloromethylene	1A1	C2v
221	SiCl2	Dichlorosilylene	1A1	C2v
222	FOO	Dioxygen monofluoride radical	2A"	Cs
223	ClOO	chloroperoxy radical	2A"	Cs
224	OClO	Chlorine dioxide	2B1	D∞h
225	ClS2	Sulfur chloride	2A"	Cs
226	NF2	Difluoroamino radical	2B1	C2v
227	F2O	Difluorine monoxide	1A1	C2v
228	Cl2O	Dichlorine monoxide	1A1	C2v
229	BHF2	Difluoroborane	1A1	C2v
230	BHCl2	Borane, dichloro-	1A1	C2v
231	CH2F2	Methane, difluoro-	1A1	C2v
232	CH2Cl2	Methylene chloride	1A1	C2v
233	CH2CHF	Ethene, fluoro-	1A'	Cs
234	C2H3Cl	Ethene, chloro-	1A'	Cs
235	CH3CH2Cl	Ethyl chloride	1A'	Cs
236	C4H6	1-Methylcyclopropene	1A	C1
237	C4H6	Cyclobutene	1A1	C2v
238	C4H6	Methylenecyclopropane	1A1	C2v
239	CH2CCHCH3	1,2-Butadiene	1A'	C1
240	CH2CHCHCH2	1,3-Butadiene	1Ag	C2h
241	CH3CCCH3	2-Butyne	1A1'	D3h
242	CH2C(CH3)CH3	1-Propene, 2-methyl-	1A1	C2v
243	CH3CHCHCH3	2-Butene, (E)-	1Ag	C2h
244	CH3CHCHCH3	2-Butene, (Z)-	1A1	C2v
245	C(CH3)3	Tert-butyl radical	2A"	C3v
246	CH2CH(CH3)2	Isobutyl radical	2A'	C1
247	CH3CHCH2CH3	2-Butyl radical	1A	C1
248	CH3CH(CH3)CH3	Isobutane	1A1	C3v
249	CH3CH2CH2CH3	Butane	1Ag	Anti
250	C2N2	Cyanogen	1Σg	D∞h
251	P4	Phosphorus tetramer	1A1	Td
252	C3H3N	acrylonitrile	1A'	Cs
253	C3H7N	Cyclopropylamine	1A'	C1
254	C4H8	cyclobutane	1A1	D2d
255	C2H8N2	Ethylenediamine	1Ag	C2h
256	CH3CH(NH2)CH3	2-Propanamine	1A'	Cs
257	N(CH3)3	Trimethylamine	1A1	C3v
258	NH2CH2CH2CH3	1-Propanamine	1A'	Cs
259	B2O2	Diboron dioxide	1Σg	D∞h
260	SO3	Sulfur trioxide	1A1'	D3h
261	HNO3	Nitric acid	1A'	Cs
262	C2H2O2	Ethanedial	1Ag	C2h
263	CH3NO2	Methane, nitro-	1A'	Cs
264	CH3ONO	Methyl nitrite	1A'	C1
265	C3H4O	Cyclopropanone	1A1	C2v
266	NH2CONH2	Urea	1A	C2
267	NH2CSNH2	Thiourea	1A	C2
268	CH3COOH	Acetic acid	1A'	Cs
269	CH3OCHO	methyl formate	1A'	Cs
270	CH3CHNOH	Acetaldoxime	1A'	CS trans
271	CH3CONH2	Acetamide	1A'	C1
272	C3H6O	Propylene oxide	1A	C1
273	CH3CH2CHO	Propanal	1A'	Cs
274	CH3COCH3	Acetone	1A1	C2v
275	C3H6S	Thietane	1A'	Cs
276	C3H6S	Thiirane, methyl-	1A	C1
277	C2H6O2	1,2-Ethanediol	1Ag	C2h
278	CH3SOCH3	Dimethyl sulfoxide	1A'	Cs
279	CH2SHCH2SH	1,2-Ethanedithiol	1Ag	C2h
280	CH3SSCH3	Disulfide, dimethyl	1A	C2
281	CH3CHOHCH3	Isopropyl alcohol	1A	C1
282	CH3OC2H5	Ethane, methoxy-	1A'	Cs
283	C3H7SH	1-Propanethiol	1A'	Cs
284	CH3CHSHCH3	2-Propanethiol	1A'	Cs
285	CH3SCH2CH3	Ethane, (methylthio)-	1A'	Cs
286	ClNO2	Nitryl chloride	1A1	C2v
287	N2F2	(Z)-Difluorodiazene	1A1	C2v
288	N2F2	Dinitrogen difluoride, (E)-	1Ag	C2h
289	CF2O	Carbonic difluoride	1A1	C2v
290	CCl2O	Phosgene	1A1	C2v
291	BF3	Borane, trifluoro-	1A'	D3h
292	AlF3	Aluminum trifluoride	1A1'	D3h
293	AlF2Cl	Aluminum chloride difluoride	1A1	C2v
294	AlFCl2	Aluminum dichloride fluoride	1A1	C2v
295	BCl3	Borane, trichloro-	1A1'	D3h
296	AlCl3	Aluminum trichloride	1A1'	D3h
297	CF3	Trifluoromethyl radical	2A1	C3v
298	CCl3	Trichloromethyl radical	2A1	C3
299	NF3	Nitrogen trifluoride	1A1	C3v
300	PF3	Phosphorus trifluoride	1A1	C3v
301	PCl3	Phosphorus trichloride	1A1	C3v
302	CHF3	Methane, trifluoro-	1A1	C3v
303	CHCl3	Chloroform	1A1	C3v
304	SiHCl3	Trichlorosilane	1A1	C3v
305	CH2CF2	Ethene, 1,1-difluoro-	1A1	C2v
306	CH2CCl2	Ethene, 1,1-dichloro-	1A1	C2v
307	CHClCHCl	Ethene, 1,2-dichloro-, (E)-	1Ag	C2h
308	CHClCHCl	Ethene, 1,2-dichloro-, (Z)-	1A1	C2v
309	CH3COF	Acetyl fluoride	1A'	NULL
310	CH3COCl	Acetyl Chloride	1A'	Cs
311	CH3CHF2	Ethane, 1,1-difluoro-	1A'	Cs
312	CH3CHFCl	Ethane, 1-chloro-1-fluoro-	1A	C1
313	CH2ClCH2Cl	Ethane, 1,2-dichloro-	1Ag	C2h
314	CH3CHCl2	Ethane, 1,1-dichloro-	1A'	Cs
315	C5H6	1,3-Cyclopentadiene	1A1	C2v
316	C5H6	1-Buten-3-yne, 2-methyl-	1A'	Cs
317	C5H6	3-Penten-1-yne, (E)-	1A'	Cs
318	C5H6	3-Penten-1-yne, (Z)-	1A'	Cs
319	C5H6	Bicyclo[2.1.0]pent-2-ene	1A'	Cs
320	C5H6	Cyclopropylacetylene	1A'	C1
321	C5H8	1,2-Butadiene, 3-methyl-	1A1	C2v
322	C5H8	1,2-Pentadiene	1A'	C1
323	C5H8	1,3-Butadiene, 2-methyl-	1A'	Cs
324	C5H8	1,3-Pentadiene, (E)-	1A'	C1
325	C5H8	1,3-Pentadiene, (Z)-	1A'	Cs
326	C5H8	1,4-Pentadiene	1A	C2
327	C5H8	2,3-Pentadiene	1A	C1
328	C5H8	Cyclobutane, methylene-	1A'	Cs
329	C5H8	Cyclopentene	1A'	Cs
330	C5H10	1-Butene, 2-methyl-	1A	C1
331	C5H10	2-Butene, 2-methyl-	1A'	Cs
332	C5H10	2-Pentene, (E)-	1A'	Cs
333	C5H10	2-Pentene, (Z)-	1A	C1
334	C5H10	Cyclopentane	1A	C1
335	C5H10	Cyclopropane, 1,1-dimethyl-	1A1	C1
336	C5H11	2-Methylbut-2-yl radical	1A	C1
337	C5H12	Butane, 2-methyl-	1A	C1
338	C5H12	Pentane	1A1	C2v
339	C5H12	Propane, 2,2-dimethyl-	1A1	Td
340	N2O3	Dinitrogen trioxide	1A'	Cs
341	C3H2N2	Malononitrile	1A1	Cs
342	C3H4N2	1H-Imidazole	1A'	Cs
343	C3H4N2	1H-Pyrazole	1A'	Cs
344	C4H5N	(E)-2-Butenenitrile	1A'	Cs
345	C4H5N	(Z)-2-Butenenitrile	1A'	Cs
346	C4H5N	Cyclopropanecarbonitrile	1A'	Cs
347	C4H5N	Pyrrole	1A1	C2v
348	C3H6N2	3-Aminopropionitrile	1A'	Cs
349	C5H8	Bicyclo[2.1.0]pentane	1A'	Cs
350	C5H8	Spiropentane	1A1	D2d
351	C4H9N	Cyclobutylamine	1A'	Cs
352	C4H9N	Pyrrolidine	1A'	Cs
353	C3H10N2	1,2-Diaminopropane	1A	C1
354	C(CH3)3NH2	2-Propanamine, 2-methyl-	1A	C1
355	C(NH2)H2C(CH3)HCH3	1-Propanamine, 2-methyl-	1A	C1
356	CH3C(NH2)HCH2CH3	2-Butanamine	1A	C1
357	C3O2	Carbon suboxide	1ΣG	D∞h
358	H2SO4	Sulfuric acid	1A	C1
359	C3H3NO	Isoxazole	1A'	Cs
360	CH3NO3	Methyl nitrate	1A'	Cs
361	C4H4O	Furan	1A1	C2
362	C4H4S	Thiophene	1A1	C2v
363	C3H4O2	β–Propiolactone	1A'	Cs
364	C3H4O2	2-Propenoic acid	1A'	Cs
365	CH2CHCONH2	Acrylamide	1A	Cs
366	CH3OCH2CN	Methoxyacetonitrile	1A'	Cs
367	CH5N3S	Hydrazinecarbothioamide	1A	C1
368	C4H6O	Cyclobutanone	1A1	C2v
369	C4H6O	Furan, 2,3-dihydro-	1A	C1
370	CH2CHOCHCH2	Vinyl ether	1A1	C2v
371	CHOCHCHCH3	2-Butenal	1A'	Cs
372	C4H6S	Thiophene, 2,3-dihydro-	1A	C1
373	C4H6S	Thiophene, 2,5-dihydro-	1A1	C2v
374	CH2CHSCHCH2	Divinyl sulfide	1A	C2v
375	C2H6N2O	Urea, methyl-	1A	C1
376	C3H6O2	1,3-Dioxolane	1A	C2
377	CH3COOCH3	methyl acetate	1A'	Cs
378	C2H6O2S	Dimethyl sulfone	1A1	C2v
379	C3H7NO	Propanamide	1A'	C1
380	C2H3OC2H5	Ethene, ethoxy-	1A	C1
381	C4H8O	Cyclobutanol	1A'	C1
382	CH2C(CH3)OCH3	1-Propene, 2-methoxy-	1A	C1
383	CH3COCH2CH3	2-Butanone	1A'	Cs
384	CHOCH(CH3)CH3	Propanal, 2-methyl-	1A'	Cs
385	CHOCH2CH2CH3	Butanal	1A'	Cs
386	C4H8S	Thiophene, tetrahydro-	1A	C1
387	C3H8O2	Hydroperoxide, 1-methylethyl	1A	C1
388	C3H8O2	Methane, dimethoxy-	1A	C2
389	C3H8O2	Propylene glycol	1A	C1
390	C3H8S2	1,3-Propanedithiol	1A1	C1
391	C4H10O	2-Butanol, (.+/-.)-	1A	C1
392	C4H10O	Ethanol, 1,1-dimethyl-	1A'	Cs
393	C4H10O	Ethoxy ethane	1A1	C2v
394	C4H10O	Propane, 2-methoxy-	1A'	Cs
395	C(CH3)3SH	2-Propanethiol, 2-methyl-	1A'	Cs
396	C2H5SC2H5	Diethyl sulfide	1A1	C2v
397	CH2(SH)CH(CH3)CH3	1-Propanethiol, 2-methyl-	1A	C1
398	CH3C(SCH3)HCH3	Propane, 2-(methylthio)-	1A	C1
399	CH3CH(SH)CH2CH3	2-Butanethiol	1A	C1
400	FNO3	Fluorine nitrate	1A'	Cs
401	ClFO3	Perchloryl fluoride	1A1	Cs
402	SO2Cl2	Sulfuryl chloride	1A1	C2v
403	F3NO	Nitrogen trifluoride oxide	1A1	C3v
404	F3PO	Phosphoryl fluoride	1A1	C3v
405	Cl3PO	Phosphoryl chloride	1A1	C3v
406	CF4	Carbon tetrafluoride	1A1	Td
407	CF3Cl	Methane, chlorotrifluoro-	1A1	C3v
408	SiF4	Silicon tetrafluoride	1A1	Td
409	CF2Cl2	difluorodichloromethane	1A1	C2v
410	CFCl3	Trichloromonofluoromethane	1A1	C3v
411	CCl4	Carbon tetrachloride	1A1	Td
412	SiCl4	Silane, tetrachloro-	1A1	Td
413	CHClCCl2	Trichloroethylene	1A'	Cs
414	HSO3F	Fluorosulfonic acid	1A	C1
415	CH3CF3	Ethane, 1,1,1-trifluoro-	1A1	C3v
416	CH3CCl3	Ethane, 1,1,1-trichloro-	1A1	C3v
417	C3H5ClO	Oxirane, (chloromethyl)-	1A	C1
418	CH2ClCHClCH3	Propane, 1,2-dichloro-	1A	C1
419	CH3CCl2CH3	Propane, 2,2-dichloro-	1A1	C2v
420	CH2CClCH2CH3	1-Butene, 2-chloro-	1A'	Cs
421	CH2CHCH2CH2Cl	1-Butene, 4-chloro-	1A	C1
422	CH2CHCHClCH3	1-Butene, 3-chloro-	1A	C1
423	CH3CClCHCH3	2-Butene, 2-chloro-, (E)-	1A'	Cs
424	CH3CClCHCH3	2-Butene, 2-chloro-, (Z)-	1A'	Cs
425	CHClCHCH2CH3	(E)-1-Chloro-1-butene	1A	C1
426	CHClCHCH2CH3	(Z)-1-Chloro-1-butene	1A'	Cs
427	CH2ClCH2CH2CH3	Butane, 1-chloro-	1A'	Cs
428	CH3CCl(CH3)CH3	Propane, 2-chloro-2-methyl-	1A1	C3v
429	CH3CHClCH2CH3	Butane, 2-chloro-	1A	C1
430	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 cation	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	Ca-	Calcium atom anion	ca-
27	Ca+	Calcium atom cation	ca+
28	Zn	Zinc atom	zn
29	Zn-	Zinc atom anion	zn-
30	Zn+	Zinc atom cation	zn+
31	BeH	beryllium monohydride	beh
32	BeH-	berylium monohydride anion	beh-
33	BeH+	beryllium monohydride cation	beh+
34	MgH	magnesium monohydride	mgh
35	MgH-	magnesium monohydride anion	mgh-
36	MgH+	magnesium monohydride cation	mgh+
37	CaH	Calcium monohydride	cah
38	CaH+	Calcium monohydride cation	cah+
39	TiH	Titanium monohydride	tih
40	ZnH	Zinc monohydride	znh
41	ZnH+	Zinc, protonated	znh+
42	BeH2	beryllium dihydride	beh2
43	BeH2+	Beryllium dihydride cation	beh2+
44	MgH2	magnesium dihydride	mgh2
45	CaH2	Calcium Hydride	cah2
46	ZnH2	Zinc hydride	znh2
47	Sc	Scandium atom	sc
48	Sc+	Scandium cation	sc+
49	Ga	Gallium atom	ga
50	Ga-	Gallium atom anion	ga-
51	Ga+	Gallium atom cation	ga+
52	BH-	boron monohydride anion	bh-
53	BH+	boron monohydride cation	bh+
54	AlH-	aluminum monohydride anion	alh-
55	AlH+	aluminum monohydride cation	alh+
56	ScH	Scandium monohydride	sch
57	ScH+	Scandium monohydride cation	sch+
58	GaH	Gallium monohydride	gah
59	GaH+	Gallium monohydride cation	gah+
60	BH2-	boron dihydride anion	bh2-
61	BH2+	Boron dihydride cation	bh2+
62	AlH2-	aluminum dihydride anion	alh2-
63	AlH2+	aluminum dihydride cation	alh2+
64	BH3-	boron trihydride anion	bh3-
65	BH3+	boron trihydride cation	bh3+
66	AlH3-	aluminum trihydride anion	alh3-
67	AlH3+	aluminum trihydride cation	alh3+
68	ScH3	Scandium trihydride	sch3
69	GaH3	Gallium trihydride	gah3
70	BH4	borohydride	bh4
71	BH4-	borohydride anion	bh4-
72	AlH4-	Aluminum tetrahydride anion	alh4-
73	Ti	Titanium atom	ti
74	Ti-	Titanium atom anion	ti-
75	Ti+	Titanium atom cation	ti+
76	Ge	Germanium atom	ge
77	Ge-	Germanium anion	ge-
78	Ge+	Germanium cation	ge+
79	Sn	Tin atom	sn
80	Sn+	Tin cation	sn+
81	CH-	methylidyne anion	ch-
82	CH+	Methylidyne cation	ch+
83	SiH-	silicon monohydride anion	sih-
84	SiH+	silicon monohydride cation	sih+
85	GeH	germylidene	geh
86	GeH+	Germaniun monohyrdide cation	geh+
87	CH2-	methylene anion	ch2-
88	CH2+	methylene cation	ch2+
89	SiH2-	silicon dihydride anion	sih2-
90	SiH2+	silicon dihydride cation	sih2+
91	GeH2	germylene	geh2
92	GeH2-	germylene anion	geh2-
93	CH3-	methyl anion	ch3-
94	CH3+	methyl cation	ch3+
95	SiH3-	Silyl anion	sih3-
96	SiH3+	Silyl cation	sih3+
97	GeH3	Germyl radical	geh3
98	GeH3+	germyl cation	geh3+
99	CD4	methane-d4	cd4
100	CH2D2	methane-d2	ch2d2
101	CH3D	methane-d	ch3d
102	CH4-	Methane anion	ch4-
103	CH4+	Methane cation	ch4+
104	CHD3	methane-d3	chd3
105	SiH2D2	silane-d2	sih2d2
106	SiH4+	Silane cation	sih4+
107	GeH4	Germane	geh4
108	SnH4	Stannane	snh4
109	SiH5+	Silane, protonated	sih5+
110	N	Nitrogen atom	n
111	V	Vanadium atom	v
112	V+	Vanadium atom cation	v+
113	As-	Arsenic anion	as-
114	As+	Arsenic cation	as+
115	Sb	Antimony atom	sb
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	ash
121	AsH+	Arsenic monohydride cation	ash+
122	SbH	Antimony monohydride	sbh
123	NH2-	amino anion	nh2-
124	NH2+	Amino cation	nh2+
125	PH2-	Phosphino anion	ph2-
126	PH2+	Phosphino cation	ph2+
127	AsH2	Arsenic dihydride	ash2
128	AsH2+	Arsenic dihydride cation	ash2+
129	NH3-	Ammonia anion	nh3-
130	NH3+	ammonia cation	nh3+
131	PH3+	Phosphine cation	ph3+
132	AsH3	Arsine	ash3
133	AsH3+	Arsine cation	ash3+
134	SbH3	Stibine	sbh3
135	AsH4+	Arsonium	ash4+
136	NH4	Ammonium radical	nh4
137	NH4+	ammonium cation	nh4+
138	PH4	Phosphoranyl radical	ph4
139	PH4+	phosphonium cation	ph4+
140	Cr	Chromium atom	cr
141	Te	Tellurium atom	te
142	Te+	Tellurium atom cation	te+
143	OH-	hydroxide anion	oh-
144	OH+	hydoxyl cation	oh+
145	HS-	mercapto anion	sh-
146	HS+	sulfur monohydride cation	sh+
147	CrH	Chromium hydride	crh
148	CrH+	Chromium hydride cation	crh+
149	HSe	Selenium monohydride	hse
150	HSe-	selenium monohydride anion	hse-
151	HSe+	selenium monohydride cation	hse+
152	TeH	Telluryl radical	teh
153	H2O-	water anion	h2o-
154	H2O+	water cation	h2o+
155	H2S-	Hydrogen sulfide anion	h2s-
156	H2S+	Hydrogen sulfide cation	h2s+
157	H2Se	Hydrogen selenide	h2se
158	H2Se+	Hydrogen selenide cation	h2se+
159	H2Te	Hydrogen Telluride	h2te
160	H3O+	hydronium cation	h3o+
161	H3S+	Sulfonium cation	h3s+
162	H3Se+	Hydrogen Selenide, protonated	h3se+
163	Mn	Manganese atom	mn
164	I	Iodine atom	iodine
165	I-	Iodine atom anion	iodine-
166	I+	Iodine atom cation	iodine+
167	HF-	hydrogen fluoride anion	hf-
168	HF+	hydrogen fluoride cation	hf+
169	HCl-	hydrogen chloride anion	hcl-
170	HCl+	hydrogen chloride cation	hcl+
171	HBr	hydrogen bromide	hbr
172	HBr-	hydrogen bromide anion	hbr-
173	HBr+	hydrogen bromide cation	hbr+
174	HI	Hydrogen iodide	hi
175	HI+	Hydrogen iodide cation	hi+
176	H2F+	dihydrogen fluoride cation	h2f+
177	H2Cl+	dihydrogen monochloride cation	h2cl+
178	H2Br+	protonated hydrogen bromide	h2br+
179	H2I+	Iodonium	h2i+
180	Fe	Iron atom	fe
181	Kr	Krypton atom	kr
182	Kr+	Krypton cation	kr+
183	Xe	Xenon atom	xe
184	HeLi+	Helium Lithium cation	heli+
185	NeH	neon hydrogen	neh
186	NeH+	neon hydrogen cation	neh+
187	ArH+	Argon hydride cation	arh+
188	KrH+	Protonated Krypton	krh+
189	XeH+	Xenon, protonated	xeh+
190	H2Ar	H2 Ar dimer	h2ar
191	Co	Cobalt atom	cobalt
192	Ni	Nickel atom	ni
193	Li2	Lithium diatomic	li2
194	Li2-	lithium diatomic anion	li2-
195	Li2+	lithium diatomic cation	li2+
196	NaLi	lithium sodium	lina
197	NaLi-	lithium sodium anion	lina-
198	NaLi+	lithium sodium cation	lina+
199	LiK	Lithium Potassium	lik
200	Na2	Sodium diatomic	na2
201	Na2-	sodium diatomic anion	na2-
202	Na2+	sodium diatomic cation	na2+
203	NaK	Sodium Potassium	nak
204	NaK+	Sodium Potassium diatomic cation	nak+
205	K2	Potassium diatomic	k2
206	Cu2	Copper diatomic	cu2
207	LiBe	Lithium Beryllium	libe
208	LiMg	Lithium magnesium	limg
209	NaBe	Sodium Beryllium	nabe
210	NaMg	Sodium Magnesium	namg
211	Be2	Beryllium diatomic	be2
212	Be2-	Beryllium diatomic anion	be2-
213	Be2+	Beryllium diatomic cation	be2+
214	BeMg	Beryllium Magnesium	bemg
215	Mg2	Magnesium diatomic	mg2
216	Mg2-	magnesium diatomic anion	mg2-
217	Mg2+	magnesium diatomic cation	mg2+
218	Ca2	Calcium diatomic	ca2
219	LiB	Lithium boride	lib
220	LiAl	Lithium Aluminum	lial
221	NaAl	Sodium aluminum	naal
222	BeB	Beryllium monoboride	beb
223	B2	Boron diatomic	b2
224	B2-	Boron diatomic anion	b2-
225	B2+	Boron diatomic cation	b2+
226	BAl	Boron Aluminum	bal
227	Al2-	aluminum diatomic anion	al2-
228	Al2+	aluminum diatomic cation	al2+
229	BGa	Boron Gallium	bga
230	AlGa	Aluminum Gallium	alga
231	Ga2	Gallium diatomic	ga2
232	HBBH	Diborane(2)	hbbh
233	LiBH4	Lithium borohydride	libh4
234	B2H4	Diborane(4) D2d	b2h4
235	HBHHBH	Diborane(4) C2V	hbhhbh
236	B2H6	Diborane	b2h6
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 radical	allyl
691	C3H5+	Allyl cation	allyl+
692	CH3CHCH	1-propenyl radical	ch3chch
693	Zn(CH3)2	dimethyl zinc	dmz
694	C3H7+	cyclopropane, protonated	c3h7+
695	CH3CHCH3+	Isopropyl cation	prop2yl+
696	SiH2(CH3)2	dimethylsilane	dms
697	Si3H8	trisilane	si3h8
698	LiCN	lithium cyanide	licn
699	NaCN	Sodium Cyanide	nacn
700	KCN	Potassium cyanide	kcn
701	CuCN	Copper cyanide	cucn
702	ZnCN	Zinc monocyanide	zncn
703	ZnNC	Zinc isocyanide	znnc
704	AlCN	Aluminum monocyanide	alcn
705	AlNC	Aluminum isocyanide	alnc
706	CN2	3H-Diazirin-3-ylidene	cn2
707	CNN	Diazocarbene	cnn
708	NCN	Cyanoimidogen	ncn
709	N3	azide radical	n3
710	N3-	azide anion	n3-
711	N3+	azide cation	n3+
712	HCCN	cyanomethylene	hccn
713	HCNN	diazomethyl radical	hcnn
714	HN3	hydrogen azide	hn3
715	HN3+	Hydrazoic acid cation	hn3+
716	HNCNH	diiminomethane	hncnh
717	CH2N2	diazirine	ch2n2
718	CH2NN	diazomethane	ch2nn
719	NH2CN	cyanamide	cyanamide
720	HNNNH+	1,2-Triazadienium	n2h3+
721	NH2NN+	hydrazoic acid, protonated	nh2nn+
722	CH3CN-	acetonitrile anion	ch3cn-
723	CH3CN+	Acetonitrile cation	ch3cn+
724	CH3NC	methyl isocyanide	ch3nc
725	CHNCH2	2H-Azirine	c157164
726	CHNHCH	1H-Azirine	chnhch
727	H2CCNH	Ethenimine	ch2cnh
728	H2CNCH	methyleneaminomethylene	ch2nch
729	HCCNH2	Ethynamine	hccnh2
730	HCNCH2+	2H-Azirine cation	hcnch2+
731	HNCNH2+	diiminomethane, protonated	hncnh2+
732	NCNH3+	Cyanamide, protonated	ncnh3+
733	NH2CNH+	cyanamide, cn protonated	nh2cnh+
734	NH3CN+	cyanamide, amine protonated	nh3cn+
735	CH2CHNH	vinylazine	ch2chnh
736	CH3CHN	methylmethaniminyl radical	ch3chn
737	NHCHNH2	aminomethanimine	cn2h4
738	CH2CHNH2	aminoethene	aminoethene
739	CH2NCH3	N-methylmethanimine	nmm
740	CH3CHNH	ethanimine	ethanimine
741	NH2BHNH2	diaminoborane	nh2bhnh2
742	C2H5NH+	Protonated Aziridine	c2h5nh+
743	C2H6N+	aziridine, protonated	c2h6n+
744	NH2CH2NH2	diaminomethane	nh2ch2nh2
745	CH3PHCH3	dimethylphosphine	ch3phch3
746	NH2CH2NH3+	diaminoethane, protonated	pdam
747	(CH3)2NH2+	dimethylammonium cation	dmam
748	CH3CH2NH3+	ethylamine, protonated	pea
749	Li2O	dilithium oxide	li2o
750	Li2O+	dilithium oxide cation	li2o+
751	Li2S	dilithium sulfide	li2s
752	Na2O	disodium monoxide	na2o
753	Na2S	Sodium sulfide	na2s
754	LiO2	Lithium dioxide	lio2
755	NaO2	Sodium superoxide	nao2
756	CCO	Dicarbon monoxide	cco
757	CNO-	fulminate	cno-
758	NCO	isocyanato radical	nco
759	NCO-	cyanate	nco-
760	SCN	thiocyanato radical	scn
761	SCN-	thiocyanide anion	scn-
762	BO2	Boron dioxide	bo2
763	BO2-	Boron dioxide anion	bo2-
764	BO2+	Boron dioxide cation	bo2+
765	N2O-	Nitrous oxide anion	n2o-
766	N2O+	Nitrous oxide cation	n2o+
767	NNS	Nitrogen sulfide	nns
768	PPO	Phosphorus oxide phosphide	ppo
769	CO2-	Carbon dioxide anion	co2-
770	CO2+	Carbon dioxide cation	co2+
771	OCS+	Carbonyl sulfide cation	cos+
772	CS2-	Carbon disulfide anion	cs2-
773	CS2+	Carbon disulfide cation	cs2+
774	TiO2	Titanium dioxide	tio2
775	SiS2	Silicon disulfide	sis2
776	GeO2	Germanium dioxide	geo2
777	OCSe	Carbonyl selenide	ocse
778	SCSe	Carbon sulfide selenide	scse
779	GeS2	Germanium disulfide	ges2
780	CSe2	Carbon diselenide	cse2
781	SCTe	Carbon sulfide Telluride	scte
782	NO2-	Nitrogen dioxide anion	no2-
783	NO2+	Nitrogen dioxide cation	no2+
784	NSO	sulfinyl amidogen	NSO
785	PO2-	Phosphorus dioxide anion	po2-
786	PO2+	Phosphorus dioxide cation	po2+
787	SNO	Nitrogen oxide sulfide	sno
788	AsO2	Aresenic dioxide	aso2
789	O3-	Ozone anion	o3-
790	O3+	Ozone cation	o3+
791	SO2-	Sulfur dioxide anion	so2-
792	SO2+	Sulfur dioxide cation	so2+
793	S3	Sulfur trimer	s3
794	S3-	Sulfur trimer anion	s3-
795	S3+	Sulfur trimer cation	s3+
796	SeO2	Selenium dioxide	seo2
797	SeO2+	Selenium dioxide cation	seo2+
798	TeO2	Tellurium Dioxide	teo2
799	HCCO	ketenyl radical	ketenyl
800	CS2H+	Carbon disulfide, protonated	cs2h+
801	HCNO	fulminic acid	hcno
802	HOCN	cyanic acid	hocn
803	HNCS	Isothiocyanic acid	hncs
804	HSCN	thiocyanic acid	hscn
805	HCO2-	formate anion	hco2-
806	HNNO	nitrosoazane	hnno
807	HNNO+	Nitrous oxide, N-protonated	hnno+
808	NNOH+	Nitrous Oxide, O-protonated	nnoh+
809	HCOO	formate neutral radical	hcoo
810	HOCO	Hydrocarboxyl radical	hoco
811	HOCO+	Hydrocarboxyl cation	hoco+
812	HNO2+	nitrous acid cation	hno2+
813	O3H+	protonated ozone	o3h+
814	SO2H+	protonated sulfur dioxide	so2h+
815	C2H2O	Oxirene	oxirene
816	CH2CO+	Ketene cation	ch2co+
817	HCCOH	ethynol	hccoh
818	CH2CS	Thioketene	ch2cs
819	Be(OH)2	Beryllium hydroxide	beo2h2
820	Mg(OH)2	Magnesium dihydroxide	h2mgo2
821	NH2NO	Nitrosamide	nh2no
822	CH2O2	Dioxirane	diox
823	H2COO	Dioxymethyl radical	h2coo
824	H2COO+	dioxymethyl cation	h2coo+
825	H2O3	Hydrogen trioxide	h2o3
826	HSSSH	trisulfane	hsssh
827	NaOCH3	Sodium methoxide	naoch3
828	CH2BOH	hydroxy(methylene)borane	ch2boh
829	BH3CO	Borane carbonyl	bh3co
830	CH3BO	Borane, methyloxo-	ch3bo
831	CH2CHO	Vinyloxy radical	ch2cho
832	CH2COH+	ketene, protonated	ch2coh+
833	CH3CO-	Acetyl anion	ch3co-
834	CH3CO+	acetyl cation	ch3co+
835	CH2NOH	formaldoxime	ch2noh
836	CH3NO	nitrosomethane	ch3no
837	CNOH3	1,2-oxaziridine	cnoh3
838	HOCHNH	hydroxymethylimine	hochnh
839	CHSNH2	thioformamide	chsnh2
840	NHCHSH	Methanimidothioic acid	nhchsh
841	CH2OOH	CH2OOH radical	ch2ooh
842	CH3OO	methylperoxy radical	ch3oo
843	CH3OO-	methylperoxy anion	ch3oo-
844	CH3OO+	methylperoxy cation	ch3oo+
845	C2H4O+	ethylene oxide cation	c2h4o+
846	CH2CHOH	ethenol	ch2choh
847	CH3CHO+	acetaldehyde cation	ch3cho+
848	H2COCH2+	Methyl, (methyleneoxoniumyl)-	h2coch2+
849	CH2CHSH	Ethenethiol	ch2chsh
850	H2CONH2+	protonated formamide	h2conh2+
851	NH2CHOH+	Formamide, O-protonated	nh2choh+
852	NH3CHO+	Formamide, N-Protonated	nh3cho+
853	CH2(OH)2	methanediol	ch2o2h2
854	CH3OOH	Methyl peroxide	ch3ooh
855	CH3SSH	Hydrogen methyl disulfide	ch3ssh
856	HSCH2SH	Methanedithiol	ch4s2
857	H2OH2CO	water formaldehyde dimer	h2oh2co
858	C2H4OH+	ethylene oxide, protonated	c2h4oh+
859	CH2CH2OH	2-hydroxy ethyl radical	ch2ch2oh
860	CH3CH2O	Ethoxy radical	ethoxy
861	CH3CHOH	1-hydroxy-ethyl radical	ch3choh
862	CH3CHOH+	acetaldehyde, protonated	ch3choh+
863	CH3OCH2	methoxymethyl radical	ch3och2
864	NH2CH2OH	aminomethanol	nh2ch2oh
865	CH3SCH3+	dimethyl sulfide cation	mesme+
866	CH3SeCH3	dimethylselenide	dmse
867	CH3OHH2O	methanol water dimer	ch3ohh2o
868	H2OCH3OH	water methanol dimer	h2och3oh
869	CuF2	Copper difluoride	cuf2
870	ZnF2	Zinc difluoride	znf2
871	CNF	iso cyanogen fluoride	cnf
872	FCN	Cyanogen fluoride	fcn
873	BrCN	Cyanogen bromide	brcn
874	ICN	Cyanogen iodide	icn
875	FBO	Boron monofluoride monoxide	fbo
876	BeF2	Beryllium fluoride	bef2
877	MgF2	Magnesium fluoride	mgf2
878	BeCl2	Beryllium chloride	becl2
879	MgCl2	Magnesium dichloride	mgcl2
880	CaCl2	Calcium Chloride	cacl2
881	ZnCl2	Zinc dichloride	zncl2
882	BeBr2	Beryllium bromide	bebr2
883	CaBr2	Calcium dibromide	cabr2
884	CaF2	Calcium difluoride	caf2
885	FCO	Carbonyl fluoride	fco
886	FCO+	Carbonyl fluoride cation	fco+
887	ClCO	carbonyl monochloride	clco
888	BF2	Boron difluoride radical	bf2
889	FNS	Thionitrosyl fluoride	fns
890	FSN	Thiazyl fluoride	fsn
891	OPCl	Phosphorus oxychloride	opcl
892	BrNO	Nitrosyl bromide	brno
893	INO	Nitrosyl iodide	ino
894	CF2-	Difluoromethylene anion	cf2-
895	CF2+	Difluoromethylene cation	cf2+
896	CFCl	chlorofluoromethylene	cfcl
897	SiF2	Silicon difluoride	sif2
898	SiF2+	Silicon difluoride cation	sif2+
899	CCl2-	dichloromethylene anion	ccl2-
900	CCl2+	dichloromethylene cation	ccl2+
901	GeF2	Germanium difluoride	gef2
902	GeCl2	Germanium dichloride	gecl2
903	CBr2	dibromomethylene	cbr2
904	FOO+	Fluorine dioxide cation	foo+
905	ClOO+	chloroperoxy cation	cloo+
906	OClO-	Chlorine dioxide anion	oclo-
907	OClO+	Chlorine dioxide cation	oclo+
908	ClSO	Sulfur chloride oxide	clso
909	BrOO	Bromine dioxide	broo
910	OBrO	Bromine dioxide radical	obro
911	NF2+	Difluoroamino cation	nf2+
912	PF2	Phosphorus difluoride	pf2
913	PF2+	Phosphorus difluoride cation	pf2+
914	FClO	chlorosyl fluoride	fclo
915	ClOF	Chlorine hypofluorite	clof
916	SF2	sulfur difluoride	sf2
917	SF2-	sulfur difluoride anion	sf2-
918	SF2+	sulfur difluoride cation	sf2+
919	SCl2	Sulfur dichloride	scl2
920	SeF2	Selenium difluoride	sef2
921	BrOCl	Bromine hypochlorite	brocl
922	SeCl2	Selenium Dichloride	secl2
923	SBr2	Sulfur dibromide	sbr2
924	SeBr2	Selenium dibromide	sebr2
925	BrOBr	Bromine oxide	brobr
926	F3-	trifluoride anion	f3-
927	Cl3-	trichloride anion	cl3-
928	Br3-	tribromide anion	br3-
929	I3-	triiodide	i3-
930	SFCl	Sulfur chloride fluoride	sfcl
931	HCCF	Fluoroacetylene	hccf
932	HCCF+	fluoroacetylene cation	hccf+
933	HCCCl	Chloroacetylene	hcccl
934	HCCBr	bromoacetylene	hccbr
935	HFCO	formyl fluoride	hfco
936	HFCO+	formyl fluoride cation	hfco+
937	COHCl	Formyl chloride	cohcl
938	COHBr	Formyl bromide	cohbr
939	CHCl2	dichloromethyl radical	chcl2
940	CHF2	difluoromethyl radical	chf2
941	CHF2+	difluoromethyl cation	chf2+
942	CHFCl	Chlorofluoromethyl radical	chfcl
943	CHFCl+	Chlorofluoromethyl cation	chfcl+
944	CHCl2+	dichloromethyl cation	chcl2+
945	CHBr2	dibromomethyl radical	chbr2
946	HOClO	Chlorous acid	hoclo
947	NHF2	difluoramine	nhf2
948	NHCl2	dichloroamine	nhcl2
949	CH2FCl	fluorochloromethane	ch2fcl
950	SiH2F2	difluorosilane	sih2f2
951	CH2BrF	Methane, bromofluoro-	ch2fbr
952	CH2BrCl	Methane, bromochloro-	ch2clbr
953	CH2FI	fluoroiodomethane	ch2fi
954	CH2Br2	dibromomethane	ch2br2
955	CH2ClI	chloroiodomethane	ch2cli
956	CH2BrI	bromoiodomethane	ch2bri
957	CH2I2	Diiodomethane	ch2i2
958	SiH2Cl2	dichlorosilane	sih2cl2
959	CH3MgBr	Methyl Magnesium Bromide	ch3mgbr
960	CH2CHF+	fluoroethene cation	ch2chf+
961	C2H3Br	vinyl bromide	c2h3br
962	C2H3I	Vinyl iodide	c2h3i
963	CH2FOH	fluoromethanol	ch2foh
964	CH3OCl	methyl hypochlorite	ch3ocl
965	CH2CH2Cl	2-chloroethyl radical	ch2ch2cl
966	CHClCH3	1-chloroethyl radical	chclch3
967	C2H5F	fluoroethane	c2h5f
968	CH3SiFH2	fluoromethylsilane	ch3sifh2
969	C2H5Br	Ethyl bromide	etbr
970	C2H5I	Ethyl iodide	c2h5i
971	KrF2	Krypton difluoride	krf2
972	XeF2	Xenon difluoride	xef2
973	B4H10	Tetraborane(10)	b4h10
974	C4	Carbon tetramer	c4
975	C4+	Carbon tetramer cation	c4+
976	C4H2	Diacetylene	c4h2
977	C4H2+	diacetlyene cation	c4h2+
978	C2H3CCH	1-Buten-3-yne	c2h3cch
979	C4H4	cyclobutadiene	cbd
980	C4H4	Tetrahedrane	c4h4
981	H2CCCCH2	Butatriene	h2cccch2
982	CHCCH2CH3	1-Butyne	c107006
983	CH3CHCHCH2	methylallyl radical	c4h7
984	C4H8	methylcyclopropane	mcp
985	CH2CHCH2CH3	1-Butene	bute1
986	B(CH3)3	trimethylborane	bme3
987	Al(CH3)3	trimethyl aluminum	tma
988	SiH(CH3)3	trimethylsilane	trimsi
989	Li3N	trilithium nitride	li3n
990	C2N2+	Cyanogen cation	c2n2+
991	As4	Arsenic tetramer	as4
992	HCCCN	Cyanoacetylene	hcccn
993	HCCCN+	Cyanoacetylene cation	hcccn+
994	H2CNCN	cyanamide, methylene	ch2ncn
995	HNCCNH	Ethenediimine	hnccnh
996	C3H3N+	acrylonitrile cation	ch2chcn+
997	CH3N3	methyl azide	ch3n3
998	NH2CCNH2	Diaminoacetylene	daa
999	NH2CH2CN	Aminoacetonitrile	aan
1000	CH3NHN2+	methyl azide, protonated	ch3nhn2+
1001	C2H5CN	ethyl cyanide	c2h5cn
1002	CH5N3	Guanidine	guanidine
1003	C4H6	Bicyclo[1.1.0]butane	c157335
1004	CH3NNCH3	(Z)-1,2-Dimethyldiazene	dmdiazz
1005	H2NCHCHNH2	diaminoethylene	dae
1006	CH6N3+	guanidinium	ch6n3+
1007	CH7N3	triaminomethane	tam
1008	C3H7N	Azetidine	azet
1009	CH3NHNHCH3	dimethyl hydrazine	dmh
1010	P(CH3)3	trimethylphosphine	tmp
1011	N(SiH3)3	trisilylamine	tsa
1012	As(CH3)3	trimethyl arsine	tmas
1013	(CH3)3NH+	protonated trimethyl amine	ptma
1014	C3H7NH3+	n-propylamine, protonated	c3h7nh2
1015	Li2O2	dilithium dioxide	li2o2
1016	Na2O2	disodium dioxide	na2o2
1017	K2O2	dipotassium dioxide	k2o2
1018	C3O	Tricarbon monoxide	c3o
1019	ONNO	NO dimer	onno
1020	S2N2	Disulfur dinitride	s2n2
1021	CO3	Carbon trioxide	co3
1022	CO3--	carbonate	co3--
1023	CS3--	Carbonotrithioate	cs3--
1024	NO3	Nitrogen trioxide	no3
1025	NO3-	nitrate anion	no3-
1026	NO3+	nitrogen trioxide cation	no3+
1027	SO3-	Sulfur trioxide anion	so3-
1028	SO3--	Sulfate dianion	so3--
1029	SO3+	Sulfur trioxide cation	so3+
1030	SeO3	selenium trioxide	seo3
1031	S4	Sulfur tetramer	s4
1032	TeO3	Tellurium trioxide	teo3
1033	HCO3-	bicarbonate anion	hco3-
1034	HSO3	Hydroxysulfonyl radical	hso3
1035	NH2NO2	nitramide	nh2no2
1036	C2H2CO	cyclopropenone	c2h2co
1037	C3H2O	Propadienal	c3h2o
1038	HCCCHO	2-propynal	hcccho
1039	C2H2O2+	Ethanedial cation	c2h2o2+
1040	H2CO3	Carbonic acid	h2co3
1041	H2CS3	thiocarbonic acid	h2cs3
1042	H2NO3+	Nitric Acid, Protonated	h2no3+
1043	H2SO3	Sulfurous acid	h2so3
1044	C2H3NO	Nitrosoethylene	c2h3no
1045	CH3NCO	methylisocyante	ch3nco
1046	HOCH2CN	cyanomethanol	hoch2cn
1047	CH3COO-	acetate anion	ch3coo-
1048	NH2COOH	Carbamic acid	nh2cooh
1049	H3BO3	Boric acid	h3bo3
1050	H3AlO3	Aluminum hydroxide	h3alo3
1051	H3CO3+	carbonic acid, protonated	h3co3+
1052	C3H4O	2-Propyn-1-ol	c107197
1053	C3H4O	allenol	c9000071
1054	C3H4O	Methylketene	c6004440
1055	CH2CHCHO	Acrolein	c3h4o
1056	NH2CONH2+	Urea cation	urea+
1057	C2H4O2	1,3-dioxetane	c2h4o2
1058	CHOCH2OH	hydroxy acetaldehyde	haa
1059	NH2COOH2+	Carbamic acid, O-protonated	nh2cooh2+
1060	NH3COOH+	protonated Carbamic acid	nh3cooh+
1061	H2OHCOOH	Water formic acid dimer 1	h2ohcooh_10
1062	H2OHCOOH	Water formic acid dimer 2	h2ohcooh_11
1063	HCOOHH2O	Formic acid water dimer	hcoohh2o
1064	HOCH2OOH	hydroxy methyl peroxide	hoch2ooh
1065	CH3COCH2	Acetonyl radical	ch3coch2
1066	CH2C(OH)NH2	1-amino vinyl alchohol	ava
1067	CH3C(OH)=NH	Ethaninidic acid	eia
1068	HCONHCH3	N-methylformamide	nmfa
1069	CH3CSNH2	Ethanethioamide	ch3csnh2
1070	CH5N2O+	urea, N-protonated	ch4n2o+
1071	H2NCOHNH2+	urea, protonated	ureah+
1072	C2H5OO	ethylperoxy radical	c2h5oo
1073	CH3NNCH3	(E)-1,2-Dimethyldiazene	dmdiaze
1074	C3H5OH	Cyclopropanol	cproh
1075	C3H6O	2-Propen-1-ol	c107186
1076	C3H6O	Acetone enol	enol
1077	C3H6O	Oxetane	oxetane
1078	CH3COCH3-	acetone anion	ch3coch3-
1079	CH3CSCH3	Thioacetone	ch3csch3
1080	CH3OOCH3	dimethylperoxide	dmp
1081	CH3COHCH3+	acetone, protonated	acetoneh+
1082	HOCH2CH2NH2	monoethanolamine	mea
1083	C3H7OH	1-Propanol	proh
1084	H2OCH3OCH3	water dimethylether dimer	h2och3och3
1085	Li2F2	Lithium fluoride dimer	li2f2
1086	Na2F2	Sodium Fluoride Dimer	na2f2
1087	Na2Cl2	Disodium dichloride	na2cl2
1088	C2F2	difluoroacetylene	c2f2
1089	C2Cl2	dichloroacetylene	c2cl2
1090	C2Cl2+	dichloroacetylene cation	c2cl2+
1091	FNO2	Nitryl fluoride	fno2
1092	FONO	Nitrosyl hypofluorite	fono
1093	ClONO	chlorine nitrite	clono
1094	BrONO	Bromine nitrite	brono
1095	CF2O+	Carbonic difluoride cation	f2co+
1096	COFCl	Carbonic chloride fluoride	cofcl
1097	Cl2CS	Thiophosgene	cl2cs
1098	COBr2	Carbonic dibromide	cobr2
1099	BF3-	Borane, trifluoro- anion	bf3-
1100	BF3+	boron trifluoride cation	bf3+
1101	BClF2	Chlorodifluoroborane	bclf2
1102	ScF3	Scandium trifluoride	ScF3
1103	BCl3+	Boron Trichloride cation	bcl3+
1104	GaF3	Gallium trifluoride	gaf3
1105	GaCl3	Gallium trichloride	gacl3
1106	BBr3	Boron tribromide	bbr3
1107	AlBr3	Aluminum Bromide	albr3
1108	ClO3	Chlorine trioxide	clo3
1109	ClO3-	chlorate anion	clo3-
1110	BrO3-	Bromate anion	bro3-
1111	CF3-	Trifluoromethyl anion	cf3-
1112	CF3+	Trifluoromethyl cation	cf3+
1113	CF2Cl	difluorochloromethyl radical	cf2cl
1114	SiF3	Silicon trifluoride radical	sif3
1115	SiF3+	Silicon trifluoride cation	sif3+
1116	CFCl2	dichlorofluoromethyl radical	cfcl2
1117	CCl3-	Trichloromethyl anion	ccl3-
1118	CCl3+	Trichloromethyl cation	ccl3+
1119	SiCl3	trichlorosilyl radical	sicl3
1120	SiCl3+	trichlorosilyl cation	sicl3+
1121	CBr3	tribromomethyl radical	cbr3
1122	FOOF	Perfluoroperoxide	foof
1123	ClO2F	Chloryl fluoride	clo2f
1124	F2SO	Thionyl Fluoride	f2so
1125	ClOOCl	Dichlorine dioxide	cloocl
1126	FSSF	Difluorodisulfane	fssf
1127	S2F2	Thio-thionyl fluoride	s2f2
1128	SOCl2	thionyl chloride	socl2
1129	SSCl2	Thiothionyl chloride	sscl2
1130	SeOCl2	selenium oxychloride	seocl2
1131	NF3-	Nitrogen trifluoride anion	nf3-
1132	NF3+	Nitrogen trifluoride cation	nf3+
1133	NCl3	nitrogen trichloride	ncl3
1134	AsF3	Arsenic trifluoride	asf3
1135	SbF3	Antimony Trifluoride	sbf3
1136	AsCl3	Arsenous trichloride	ascl3
1137	SbCl3	Antimony Trichloride	sbcl3
1138	NBr3	Nitrogen Tribromide	nbr3
1139	PBr3	Phosphorus tribromide	pbr3
1140	AsBr3	Arsenic tribromide	asbr3
1141	NI3	Nitrogen triiodide	ni3
1142	PI3	Phosphorus triiodide	pi3
1143	ClSSCl	Disulfur dichloride	s2cl2
1144	SF3	Sulfur trifluoride	sf3
1145	ClF3	Chlorine trifluoride	clf3
1146	BrF3	Bromine trifluoride	brf3
1147	IF3	iodone trifluoride	if3
1148	HClO3	Chloric Acid	hclo3
1149	CHF2Cl	difluorochloromethane	chf2cl
1150	SiHF3	trifluorosilane	sihf3
1151	CHFCl2	fluorodichloromethane	chfcl2
1152	CDCl3	trichloromethane-d	cdcl3
1153	CHBrF2	Methane, bromodifluoro-	chbrf2
1154	CHFClBr	fluorochlorobromomethane	chfclbr
1155	CHBrCl2	Methane, bromodichloro-	chbrcl2
1156	CHF2I	difluoroiodomethane	chf2i
1157	CHBr2F	dibromofluoromethane	chbr2f
1158	CHFClI	fluorochloroiodomethane	chfcli
1159	CHCl2I	dichloroiodomethane	chcl2i
1160	CHClBr2	Methane, dibromochloro-	chclbr2
1161	CHBr3	bromoform	chbr3
1162	CHI3	Iodoform	chi3
1163	NF3H+	protonated nitrogen trifluoride	nf3h+
1164	AsF3H+	Arsenic trifluoride, protonated	asf3h+
1165	C2H2F2	Ethene, 1,2-difluoro-, (E)-	c2h2f2e
1166	C2H2F2	Ethene, 1,2-difluoro-, (Z)-	c2h2f2z
1167	C2H2ClF	1-chloro-1-fluoroethylene	c2h2clf
1168	CHFCHCl	(E)-1-chloro-2-fluoroethene	chfchcle
1169	CHFCHClz	(Z)-1-Chloro-2-fluoroethene	chfchclz
1170	C2H2Br2	1,1-dibromoethene	c2h2br2
1171	CHBrCHBr	Ethene, 1,2-dibromo-, (E)-	chbrchbre
1172	CHBrCHBr	Ethene, 1,2-dibromo-, (Z)-	chbrchbrz
1173	CH2FCHO	Fluoroacetaldehyde	ch2fcho
1174	CH2ClCHO	chloroacetaldehyde	ch2clcho
1175	C2H4F2	1,2-difluoroethane	c2h4f2
1176	CH2FCH2Cl	Ethane, 1-chloro-2-fluoro-	ch2fch2cl
1177	CH2BrCH2Cl	1-bromo-2-chloroethane	ch2brch2cl
1178	CH2BrCH2Br	Ethane, 1,2-dibromo-	ch2brch2br
1179	CH2CFCH3	2-fluoropropene	2fpro
1180	CH2CHCH2F	Allyl Fluoride	allylf
1181	CH3CHCHF	trans-1-Fluoro-1-propene	propene1ft
1182	C3H5Cl	1-Propene, 3-chloro-	prop1cl3
1183	C3H5Cl	1-chloro-1-propene(E)	prop1cl1e
1184	C3H5Cl	1-chloro-1-propene(Z)	prop1cl1z
1185	CH2FCH2OH	2-fluoroethanol	ch2fch2oh
1186	CH2ClCH2OH	2-Chloroethanol	ch2clch2oh
1187	CH2ClCH2OH2+	2-chloroethanol, protonated	ch2clch2oh2+
1188	CH2FCH2CH3	1-Fluoropropane	prf1
1189	CH3CHFCH3	2-Fluoropropane	prf2
1190	CH2ClCH2CH3	Propane, 1-chloro-	prcl1
1191	CH3CHClCH3	Propane, 2-chloro-	prcl2
1192	CH3CH2CH2Br	n-propyl bromide	prbr
1193	CH3CHBrCH3	i-propyl bromide	iprbr
1194	C3H9O+	trimethyl oxonium cation	c3h9o+
1195	B5H9	pentaborane9	b5h9
1196	C5H4	pentatetraene	ptrene
1197	C5H5	cyclopentadienyl radical	c5h5
1198	C5H5-	cylopentadienyl anion	c5h5-
1199	C5H6	Propellane	propellane
1200	C5H7	1,3-pentadienyl radical	pdyl
1201	C5H7	cyclopentenyl radical	cpyl
1202	C5H8	1-pentyne	a1pentyne
1203	C5H8	Bicyclo[1.1.1]pentane	bcp
1204	C5H8	Ethenylcyclopropane	c693867
1205	CH3CCCH2CH3	2-Pentyne	2pentyne
1206	CH2CHCH2CH2CH3	1-pentene	pentene
1207	Si(CH3)4	tetramethylsilane	tms
1208	CH2N4	1H-Tetrazole	1htz
1209	C3H3N2	imidazolyl radical	im
1210	C3H3N2-	imidizolyl anion	im-
1211	C2H3N3	1H-1,2,4-Triazole	c288880
1212	C4H4N	pyrrolide radical	c4h4n
1213	C4H4N-	pyrrolide anion	c4h4n-
1214	C3H4N2	2H-Imidazole	imid2h
1215	C3H4N2	4H-Imidazole	imid4h
1216	C4H5N	2H-pyrrole	pyrrole2
1217	C4H5N	3H-pyrrole	pyrrole3
1218	CH2CHCH2CN	Allylcyanide	ch2chch2cn
1219	C4H6N+	pyrrole, alpha-protonated	appyr
1220	C4H6N+	pyrrole, beta-protonated	bppyr
1221	C4H6N+	pyrrole, protonated	ppyr
1222	CH3CH(CH3)CN	Propanenitrile, 2-methyl-	c4h7n
1223	CH3CH2CH2CN	Butanenitrile	c109740
1224	C(NH2)H2CH2CH2CH3	1-Butanamine	butam1
1225	NH(C2H5)2	diethylamine	dea
1226	NC4H12+	tetramethyl ammonium cation	nc4h12+
1227	C3O2+	Carbon suboxide cation	c3o2+
1228	B2O3	diboron trioxide	b2o3
1229	MgCO3	Magnesium Carbonate	mgco3
1230	BeCO3	Beryllium Carbonate	beco3
1231	CaCO3	Calcium Carbonate	caco3
1232	ONONO	Nitrosyl nitrite	onono
1233	PO4---	phosphate	po4---
1234	SO4--	sulfate	so4--
1235	HOONO2	peroxy nitric acid	hoono2
1236	HSO4-	bisulfate anion	hso4-
1237	C2H2N2S	1,3,4-Thiadiazole	c2h2n2s
1238	C3H2O2	Propiolic acid	c3h2o2
1239	CHOCOOH	oxo acetic acid	oaa
1240	CHOOCHO	diformyl ether	choocho
1241	H2SeO4	Selenic acid	h2seo4
1242	C3H3NO	Oxazole	oxazole
1243	C3H3NS	Thiazole	thiazole
1244	CH3C(O)OO	acetyl peroxy radical	ch3coo2
1245	H3PO4	Phosphoric Acid	h3po4
1246	C4H4O+	Furan cation	furan+
1247	CH3COCCH	3-butyn-2-one	c1423605
1248	C4H4Se	selenophene	c4h4se
1249	C3H4O2	Methyl glyoxal	megly
1250	C3H4O2	propanedial	propanedial
1251	C3H4O2	propenalol	propenalol
1252	HOCHCCHOH	allenediol	aldiol
1253	C2H4O3	1,2,3-trioxolane	c2h4o3
1254	C2H4O3	trioxolane124	triox
1255	HOCH2COOH	Hydroxyacetic acid	hac
1256	H2NCH2COOH	Glycine	glycine
1257	CH3SO2NH2	methanesulfonamide	ch3so2nh2
1258	C4H6O	cis-2-butenal	butenal2c
1259	C4H6O	Furan, 2,5-dihydro-	furan25h
1260	CH3CH2COOH	Propanoic Acid	propanoic
1261	HCOOC2H5	Ethyl formate	faee
1262	CH3SSSCH3	dimethyl trisulfide	c2h6s3
1263	C3H7NO	dimethylformamide	dmf
1264	C4H8O	Furan, tetrahydro-	thf
1265	C3H8O2	1,3-Propanediol	c504632
1266	C4H10O	1-Butanol	butanol1
1267	C4H10O	1-Propanol, 2-methyl-	c78831
1268	C4H10O	Methyl propyl ether	meopr
1269	C4H10O+	1-Butanol cation	butanol1+
1270	C4H9SH	1-Butanethiol	bush
1271	ClONO2	Chlorine nitrate	clono2
1272	BrONO2	Bromine nitrate	brono2
1273	TiCl4	Titanium tetrachloride	ticl4
1274	ClO4-	perchlorate anion	clo4-
1275	BF4-	tetrafluoroboron anion	bf4-
1276	SO2F2	Sulfuryl fluoride	so2f2
1277	TiF4	Titanium tetrafluoride	tif4
1278	CF3Br	Bromotrifluoromethane	cf3br
1279	GeF4	Germanium tetrafluoride	gef4
1280	CCl4+	Carbon tetrachloride cation	ccl4+
1281	CBrClF2	Methane, bromochlorodifluoro-	cbrclf2
1282	CBrCl2F	bromodichlorofluoromethane	cbrcl2f
1283	CF3I	trifluoroiodomethane	cf3i
1284	CBrCl3	Methane, bromotrichloro-	cbrcl3
1285	CBr2F2	Methane, dibromodifluoro-	cbr2f2
1286	GeCl4	Germanium Tetrachloride	gecl4
1287	CBr2ClF	dibromochlorofluoromethane	cbr2clf
1288	CBr2Cl2	dibromodichloromethane	cbr2cl2
1289	CCl3I	trichloroiodomethane	ccl3i
1290	CFBr3	fluorotribromomethane	cfbr3
1291	CFClBrI	fluorochlorobromoiodomethane	cfclbri
1292	CBr3Cl	tribromochloromethane	cbr3cl
1293	CF2I2	difluorodiiodomethane	cf2i2
1294	CBr4	Carbon tetrabromide	cbr4
1295	CCl2I2	dichlorodiiodomethane	ccl2i2
1296	SiBr4	Silicon tetrabromide	sibr4
1297	CBr3I	tribromoiododmethane	cbr3i
1298	GeBr4	Germanium tetrabromide	gebr4
1299	CI4	tetraiodomethane	ci4
1300	SiI4	silicon tetraiodide	sii4
1301	ClOF3	Chlorine trifluoride oxide	clof3
1302	SF4	Sulfur tetrafluoride	sf4
1303	SeF4	Selenium tetrafluoride	sef4
1304	SCl4	Sulfur tetrachloride	scl4
1305	C2HF3	Trifluoroethylene	c2hf3
1306	C2HF3+	Trifluoroethylene cation	c2hf3+
1307	CHBrCF2	1-Bromo-2,2-difluoroethylene	chbrcf2
1308	HClO4	perchloric acid	hclo4
1309	CF3OH	trifluoromethanol	cf3oh
1310	CH2ClCCCl	1,3-dichloropropyne	ch2clcccl
1311	CHClCCHCl	1,3-dichloroallene	chclcchcl
1312	CHCl2CCH	3,3-dichloropropyne	chcl2cch
1313	CHCl2CHO	dichloroacetaldehyde	chcl2cho
1314	PF3CH2	phosphorane, trifluoromethylene-	pf3ch2
1315	CHF2CH2F	Ethane, 1,1,2-trifluoro	ch2fchf2
1316	CH3CF2Cl	1-Chloro-1,1-Difluoroethane	ch3cf2cl
1317	CH3CFCl2	1,1-Dichloro-1-fluoroethane	ch3cfcl2
1318	CH2ClCHCl2	1,1,2-trichloroethane	ch2clchcl2
1319	SiCl3CH3	methyltrichlorosilane	sicl3ch3
1320	CH3CBr3	1,1,1-tribromoethane	ch3cbr3
1321	NH3BCl3	Amminetrichloroboron	nh3bcl3
1322	SiH3CCl3	(trichloromethyl)silane	sih3ccl3
1323	CH2CClCHCH2	1,3-Butadiene, 2-chloro-	c4h5cl
1324	CH2FCH2CH2F	1,3-difluoropropane	ch2fch2ch2f
1325	CH3CF2CH3	2,2-difluoropropane	ch3cf2ch3
1326	CH2ClCH2CH2Cl	1,3-dichloropropane	prdicl13
1327	CHCl2CH2CH3	1,1-dichloropropane	prdicl11
1328	SiCl2(CH3)2	dichlorodimethylsilane	sicl2me2
1329	CH2ClCHCHCH3	2-Butene, 1-chloro-	bute2cl1
1330	C4H9F	1-fluorobutane	butaf1
1331	CH3CHFCH2CH3	2-fluorobutane	butaf2
1332	XeF4	Xenon tetrafluoride	xef4
1333	C2H2N2O	Furazan	furazan
1334	CF3PH2	phosphine, (trifluoromethyl)-	cf3ph2
1335	NH3BF3	Amminetrifluoroboron	nh3bf3
1336	C6H2	hexatriyne	c6h2
1337	C6H4	(E)-Hexa-1,5-diyne-3-ene	c6h4e
1338	C6H4	(Z)-Hexa-1,5-diyne-3-ene	c6h4z
1339	C6H4	Benzyne	benzyne
1340	C6H5	phenyl	phenyl
1341	C6H5-	phenyl anion	phenyl-
1342	C6H6	Prismane	prismane
1343	C6H6	1,2,4,5-Hexatetraene	ht1245
1344	C6H6	2,4-Hexadiyne	hexadiyne
1345	C6H6	3,4-Dimethylenecyclobutene	cb34m
1346	C6H6	Benzene	benzene
1347	C6H6	Benzvalene	bv
1348	C6H6	Dewar Benzene	dewar
1349	C6H6	Hexa-1,5-diene-3-yne	hdy153
1350	C6H6	Trimethylenecycopropane	tmcp
1351	C6H6+	Benzene cation	c6h6+
1352	C6H7+	benzene, protonated	c6h7+
1353	C6H8	(E)-hexa-1,3,5-triene	c821078
1354	C6H8	(E)-hexa-2,3,4-triene	c59660650
1355	C6H8	(Z)-hexa-1,3,5-triene	hexatri135
1356	C6H8	(Z)-hexa-2,3,4-triene	hetr234c
1357	C6H8	1,3-Cyclohexadiene	cyhexadiene13
1358	C6H8	1,4-Cyclohexadiene	cyhexadiene14
1359	C6H8	3-Methylenecyclopentene	c930267
1360	C6H8	Bicyclo[2.1.1]hex-2-ene	c822413
1361	C6H8	Bicyclo[2.2.0]hex-1(4)-ene	c30830207
1362	C6H8	Bicyclo[3.1.0]hex-2-ene	c694019
1363	C6H10	1,3-Hexadiene, (E)-	hexdi13e
1364	C6H10	1,3-Hexadiene, (Z)-	hexdi13z
1365	C6H10	1,4-Hexadiene, (E)-	hexdi14t
1366	C6H10	1,4-Hexadiene, (Z)-	hexdi14z
1367	C6H10	1,5-Hexadiene	c592427
1368	C6H10	1-Butyne, 3,3-dimethyl-	c917920
1369	C6H10	1-Hexyne	hexyne1
1370	C6H10	2,4-Hexadiene, (E,E)-	hexdi24ee
1371	C6H10	2,4-Hexadiene, (E,Z)-	hexdi24ez
1372	C6H10	2,4-Hexadiene, (Z,Z)-	hexdi24zz
1373	C6H10	2-Hexyne	c764352
1374	C6H10	3-Hexyne	hexyne3
1375	C6H10	cyclohexene	cyclohexene
1376	C6H10	Cyclopentene, 1-methyl-	c693890
1377	C6H10	Cyclopentene, 3-methyl-	c1120623
1378	C6H10	Cyclopentene, 4-methyl-	c1759815
1379	C4H6(CH3)2	1,1-dimethylcyclobutane	dmcb11
1380	C6H12	(1R,2R)-1,2-dimethylcyclobutane	dmcb12t
1381	C6H12	(1r,3r)-1,3-dimethylcyclobutane	dmcb13t
1382	C6H12	(E)-2-Hexene	e2hexene
1383	C6H12	(E)-3-methylpent-2-ene	c616126
1384	C6H12	(E)-hex-3-ene	e3hexene
1385	C6H12	(Z)-3-methylpent-2-ene	c922623
1386	C6H12	(Z)-hex-2-ene	z2hexene
1387	C6H12	(Z)-hex-3-ene	z3hexene
1388	C6H12	2,3-dimethylbut-1-ene	c563780
1389	C6H12	2,3-dimethyl-but-2-ene	tmeet
1390	C6H12	3-methylenepentane	c760214
1391	C6H12	cis-1,2-dimethylcyclobutane	dmcb12c
1392	C6H12	cis-1,3-dimethylcyclobutane	dmcb13c
1393	C6H12	Cyclohexane	cyclohexane
1394	C6H12	Cyclopentane, methyl-	c96377
1395	C6H12	Ethylcyclobutane	c4806615
1396	C6H12	hex-1-ene	hexene1
1397	C6H14	Butane, 2,2-dimethyl-	buta22
1398	C6H14	Butane, 2,3-dimethyl-	buta23
1399	C6H14	Hexane	hexane
1400	C6H14	Pentane, 2-methyl-	penta2
1401	C6H14	Pentane, 3-methyl-	penta3
1402	C4N2	2-Butynedinitrile	c4n2
1403	N3P3	1,3,5,2,4,6-Triazatriphosphorine	n3p3
1404	C4H2N2	Fumaronitrile	c4h2n2
1405	C2H2N4	sym-tetrazine	ttz
1406	C3H3N3	1,3,5-Triazine	triazine135
1407	CH3N5	5-Aminotetrazole	c4418615
1408	C4H4N2	1,3-Diazine	diazine13
1409	C4H4N2	Pyrazine	pyrazine
1410	C4H4N2	Pyridazine	pyridazine
1411	C4H4N2	Succinonitrile	c110612
1412	C2H4N4	1H-Tetrazole, 1-methyl-	c16681779
1413	C2H4N4	1H-Tetrazole, 5-methyl-	c4076362
1414	C2H4N4	2H-Tetrazole, 2-methyl-	c16681780
1415	C5H5N	Bicyclo[1.1.0]butane-1-carbonitrile	bibucn
1416	C5H5N	E-2,4-pentadienenitrile	bdcn
1417	C5H5N	Pyridine	pyridine
1418	B3N3H6	borazine	borazine
1419	C6H6	Fulvene	fulvene
1420	C5H6N+	Pyridinium	c5h6n
1421	C4H6N2	1H-Imidazole, 2-methyl-	c693981
1422	C5H7N	(E)-2-Pentenenitrile	c26294984
1423	C5H7N	(E)-3-Pentenenitrile	c16529661
1424	C5H7N	(Z)-2-Pentenenitrile	c25899507
1425	C5H7N	1H-Pyrrole, 1-methyl-	c96548
1426	C5H7N	Cyclobutanecarbonitrile	c4426113
1427	C5H9N	1,2,3,6-Tetrahydropyridine	c694053
1428	C5H9N	Butanenitrile, 2-methyl-	c18936179
1429	C5H9N	Pentanenitrile	c110598
1430	C5H9N	Propanenitrile, 2,2-dimethyl-	c630182
1431	C6H10	Bicyclo[3.1.0]hexane	c285585
1432	C5H11N	Cyclopentanamine	cypentam
1433	C5H11N	Piperidine	piper
1434	C4H12N2	1,2-Butanediamine	c4426486
1435	C4H12N2	2-Methyl-1,2-propanediamine	c811938
1436	Li2CO3	Lithium Carbonate	li2co3
1437	Na2CO3	Sodium Carbonate	na2co3
1438	C2O4--	oxalate anion	c2o4
1439	MgSO4	Magnesium Sulfate	mgso4
1440	N2O4	Dinitrogen tetroxide	n2o4
1441	C3H2O3	vinylene carbonate	vica
1442	C2H2O4	Oxalic Acid	oxalic
1443	C2H3NO3	Oxamic acid	oxamic
1444	C4H4O2	2(5H)-Furanone	furanone
1445	C4H4O2	2-Oxetanone, 4-methylene-	c674828
1446	C2H4N2O2	Oxalamide	oxalamide
1447	C2H4N2S2	Ethanedithioamide	c79403
1448	C2H4CO3	Ethylene carbonate	etco3
1449	C3H4O2S	2H-Thiete-1,1-dioxide	c7285327
1450	C3H4S3	1,3-Dithiolane-2-thione	c822388
1451	C2H4O4	Formic acid dimer	fadimer
1452	C4H5NO	3-Methylisoxazole	isox3m
1453	C4H5NO	Isoxazole, 5-methyl-	c5765446
1454	C4H5NS	4-Methylthiazole	c693958
1455	C2H5NO3	Nitric acid, ethyl ester	c625581
1456	C5H6O	2H-Pyran	pyran2
1457	C5H6O	2-methylfuran	furan2m
1458	C5H6O	3-Methylfuran	furan3m
1459	C5H6O	Pentadienal	pdal
1460	C5H6S	Thiophene, 2-methyl-	c554143
1461	C5H6S	Thiophene, 3-methyl-	c616444
1462	C4H6O2	γ–Butyrolactone	c96480
1463	C4H6O2	2,3-Butanedione	c431038
1464	C4H6O2	2-Propenoic acid, methyl ester	c96333
1465	C4H6O2	Crotonic Acid	crot
1466	C4H6OS	2,3-dihydrothiophene-2-ol	c9000117
1467	C4H6OS	2,5-dihydrothiophene-3-ol	c9000093
1468	C4H6OS	4,5-dihydrothiophene-2-ol	c9000106
1469	C4H6OS	4,5-dihydrothiophene-3-ol	c9000082
1470	C4H6OS	Dihydro-2-(3H)-thiophenone	c1003107
1471	C4H6OS	Dihydro-3-(2H)-thiophenone	c1003049
1472	C4H6OS	Vinyl sulfoxide	c1115157
1473	CH6N4S	Carbonothioic dihydrazide	thiacarb
1474	C2H6N2O2	(E)-Azodioxymethane	c37765154
1475	C2H6N2O2	Dimethylnitroamine	c4164287
1476	C3H6O3	1,3,5-Trioxane	trioxane
1477	C3H6S3	1,3,5-Trithiane	c3h6s3
1478	C3H6S3	Carbonotrithioic acid, dimethyl ester	c2314489
1479	C2H6O3S	Sulfurous acid, dimethyl ester	c616422
1480	C4H7NO	2-Pyrrolidinone	c616455
1481	C4H7NO	Ethoxyacetonitrile	etoaccn
1482	C4H7NO	Methacrylamide	c79390
1483	C4H7NO	Oxazole, 4,5-dihydro-2-methyl-	c1120645
1484	HCONH2CN2H4	formamide aminomethanimine dimer	d13
1485	C3H7ONO	Propyl nitrite	prono
1486	CH3CH(CH3)ONO	Isopropyl nitrite	c541424
1487	CH3CH(NH2)COOH	Alanine	alanine
1488	CH3NHCH2COOH	Sarcosine	sarcosine
1489	NH2CH2CH2COOH	β–alanine	betaalanine
1490	NH2COOC2H5	Urethane	urethane
1491	C5H8O	2H-Pyran, 3,4-dihydro-	c110872
1492	C5H8O	Cyclopentanone	c120923
1493	C5H8O	Furan, 2,3-dihydro-5-methyl-	c1487156
1494	C5H8O	Methyl cyclopropyl ketone	c765435
1495	N(CH3)2CONH2	Urea, N,N-dimethyl-	c598947
1496	NH(CH3)CONH(CH3)	Urea, N,N'-dimethyl-	c96311
1497	NH2CONHC2H5	Urea, ethyl-	c625525
1498	C4H8O2	1,3-Dioxane	dioxan13
1499	C4H8O2	1,3-Dioxolane, 2-methyl-	c497267
1500	C4H8O2	1,4-Dioxane	dioxan14
1501	C4H8O2	Ethene, 1,1-dimethoxy-	c922690
1502	C4H8O2	Ethyl acetate	c141786
1503	C4H8OS	s-Ethyl thioacetate	c625605
1504	C3H8O3	1,2,3-Propanetriol	glycerin
1505	C3H8O2S	(Methylsulfonyl)ethane	c594434
1506	C4H9NO	Butanamide	c541355
1507	C4H9NO	Propanamide, 2-methyl-	c563837
1508	C5H10O	2-Butanone, 3-methyl-	c563804
1509	C5H10O	2H-Pyran, tetrahydro-	c142687
1510	C5H10O	2-methylbutyraldehyde	2meba
1511	C5H10O	2-Pentanone	mpk
1512	C5H10O	3-Pentanone	dek
1513	C5H10O	Cyclopentanol	c96413
1514	C5H10O	Oxetane, 3,3-dimethyl-	c6921353
1515	C5H10O	Pentanal	pal
1516	C5H10S	2H-Thiopyran, tetrahydro-	c1613510
1517	C5H10S	3-Ethylthio-1-propene	c5296628
1518	C5H10S	Cyclopentanethiol	c1679078
1519	C5H10S	Thiophene, tetrahydro-2-methyl-	c1795091
1520	C5H10S	Thiophene, tetrahydro-3-methyl-	c4740005
1521	C4H10O2	1,1-Dimethoxyethane	c534156
1522	C4H10O2	1,3-Butanediol	budiol13
1523	C4H10O2	1,4-Butanediol	budiol14
1524	C4H10O2	Ethane, 1,2-dimethoxy-	c110714
1525	C4H10OS	Diethyl sulfoxide	c70291
1526	C4H10S2	1,4-Butanedithiol	budisl14
1527	C4H11NO	Diethylhydroxylamine	c3710847
1528	C5H12O	1-Butanol, 2-methyl-	c137326
1529	C5H12O	1-Butanol, 3-methyl-	c123513
1530	C5H12O	1-Pentanol	pentanol1
1531	C5H12O	2-Butanol, 3-methyl-	c598754
1532	C5H12O	2-Pentanol	peol2
1533	C5H12O	3-Pentanol	pentan3ol
1534	C5H12O	Butane, 1-methoxy-	meobu
1535	C5H12O	Propane, 1-ethoxy-	proet
1536	C5H12O	Propane, 2-methoxy-2-methyl-	c1634044
1537	C5H12S	1-Butanethiol, 2-methyl-	c1878188
1538	C5H12S	1-Butanethiol, 3-methyl-	c541311
1539	C5H12S	1-Pentanethiol	c110667
1540	C5H12S	1-Propanethiol, 2,2-dimethyl-	c1679089
1541	C5H12S	2-Butanethiol, 2-methyl-	c1679090
1542	C5H12S	2-Butanethiol, 3-methyl-	c2084186
1543	C5H12S	Butane, 1-(methylthio)-	c628295
1544	C5H12S	Ethyl propyl sulfide	c4110503
1545	C5H12S	Propane, 2-(ethylthio)-	c5145993
1546	C5H12S	Propane, 2-methyl-2-(methylthio)-	c6163640
1547	C4F2	difluorobutadiyne	c4f2
1548	ClCOClCO	Oxalyl chloride	oxcl
1549	CF3CN	Acetonitrile, trifluoro-	cf3cn
1550	CF3CN+	Acetonitrile, trifluoro- cation	cf3cn+
1551	B2F4	Diboron tetrafluoride	b2f4
1552	B2Cl4	Diboron tetrachloride	b2cl4
1553	C2F4	Tetrafluoroethylene	c2f4
1554	C2F4+	Tetrafluoroethylene cation	c2f4+
1555	C2ClF3	Ethene, chlorotrifluoro-	c2f3cl
1556	CF2CCl2	difluorodichloroethylene	cf2ccl2
1557	CFClCClF	trans-1,2-dichloro-1,2-difluoroethylene	cfclcclf
1558	CFClCFCl	cis-1,2-dichloro-1,2-difluoroethylene	cfclcfcl
1559	C2FCl3	fluorotrichloroethene	c2fcl3
1560	C2Cl4	Tetrachloroethylene	c2cl4
1561	C2Br4	tetrabromoethene	c2br4
1562	CF3OF	Trifluoromethylhypofluorite	cf3of
1563	SiF5-	silicon pentafluoride anion	sif5-
1564	SOF4	Sulfur tetrafluoride oxide	sof4
1565	PF5	Phosphorus pentafluoride	pf5
1566	AsF5	Arsenic pentafluoride	asf5
1567	PCl5	Phosphorus pentachloride	pcl5
1568	SF5	Sulfur pentafluoride	sf5
1569	SF5+	pentafluoro sulfur cation	sf5+
1570	SbCl5	Antimony pentachloride	sbcl5
1571	BrF5	bromine pentafluoride	brf5
1572	ClF5	chlorinepentafluoride	clf5
1573	IF5	pentafluoroiodine	if5
1574	CF3CHO	trifluoroacetaldehyde	cf3cho
1575	CCl3CHO	trichloroacetaldehyde	ccl3cho
1576	CHFClCHClF	ethane, 1,2-dichloro-1,2-difluoro-	chfclchclf
1577	CF3CH2F	1,1,1,2-tetrafluoroethane	cf3ch2f
1578	CHF2CHF2	1,1,2,2-tetrafluoroethane	chf2chf2
1579	CF3CH2Cl	2,2,2-Trifluoroethyl chloride	cf3ch2cl
1580	CHFClCHFCl	1,2-dichloro-1,2-difluoroethane RR	chfclchfcl
1581	CH2ClCCl3	1,1,1,2-tetrachloroethane	ch2clccl3
1582	CHCl2CHCl2	Ethane, 1,1,2,2-tetrachloro-	chcl2chcl2
1583	CH2BrCBr3	1,1,1,2-tetrabromo ethane	c2h2br4
1584	CHCl2CHF2	1,1-dichloro-2,2-difluoroethane	c2h2cl2f2
1585	CF3COOH	trifluoroacetic acid	cf3cooh
1586	C4H3ClO	Furan, 2-chloro	fur2cl
1587	C4H3ClO	Furan,3-chloro	fur3cl
1588	C3H5ClO2	Carbonochloridic acid, ethyl ester	c541413
1589	C3H5Cl3	Propane, 1,2,3-trichloro-	prcl135
1590	C4H8Cl2	1,4-Dichlorobutane	c110565
1591	C4H8Cl2	Butane, 1,2-dichloro-	c616217
1592	C4H8Cl2	Butane, 1,3-dichloro-	c1190223
1593	C4H8Cl2	Butane, 2,3-dichloro-, (r*,r*)-(.+/-.)-	c2211678
1594	C4H8Cl2	Butane, 2,3-dichloro-, (r*,s*)-	c4028562
1595	C4H9ClO	1-Chloro-2-ethoxyethane	c628342
1596	C5H11Cl	Pentane, 1-chloro-	pencl1
1597	C4H8O2	Butanoic acid	bua
1598	C6H5CH2	benzyl radical	benzyl
1599	C7H7	cycloheptatrienyl radical	c7h7
1600	C7H7+	cycloheptatrienyl cation	c7h7+
1601	C6H5CH3	toluene	toluene
1602	C7H8	cycloheptatriene	cht
1603	C7H8	Norbornadiene	norbor
1604	C7H8	Quadricyclane	qucy
1605	C7H12	Norbornane	nor
1606	C7H14	cycloheptane	c7h14
1607	C7H16	2-methylhexane	2mhex
1608	C7H16	3-methylhexane	hex3m
1609	C7H16	heptane	heptane
1610	CH(CN)3	tricyanomethane	mecn3
1611	HN=C=C(CN)2	Dicyanoketenimine	c4hn3
1612	C6H7N	2-Methylpyridine	mp
1613	C6H5NH2	aniline	aniline
1614	C6H13N	2-Methylpiperidine	pip2m
1615	C6H13N	cyclohexanamine	cham
1616	C6H15N	triethylamine	tea
1617	N2O5	Dinitrogen pentoxide	n2o5
1618	C4H2O3	Maleic Anhydride	malan
1619	C5H4O2	4-Cyclopentene-1,3-dione	cpdio
1620	C5H4O2	furfural	furfural
1621	C6H5O	phenoxy radical	phenoxy
1622	C5H5NO	2(1H)-Pyridinone	c72762006
1623	C5H5NO	2(3H)-Pyridinone	c9000048
1624	C5H5NO	2(5H)-Pyridinone	c9000037
1625	C5H5NO	2-Pyridinol	c109104
1626	C5H5NO	3(2H)-Pyridinone	c9000004
1627	C5H5NO	3(4H)-Pyridinone	c9000026
1628	C5H5NO	3(6H)-Pyridinone	c9000015
1629	C5H5NO	3-Pyridinol	c109002
1630	C5H5NO	4(1H)-Pryidinone	c9000060
1631	C5H5NO	4(3H)-Pryidinone	c9000059
1632	C5H5NO	4-Pyridinol	c626642
1633	C6H5OH	phenol	phenol
1634	C6H6O	2,4-Cyclohexadienone	c24599573
1635	C6H6O	2,5-Cyclohexadienone	c5664335
1636	C6H5SH	Benzenethiol	phsh
1637	HO2CCHNH2CH2OH	Serine	serine
1638	C5H8O2	Acetylacetone	acac
1639	C4H8O2S	Sulfolane	sulfolane
1640	C7H10	Norbornene	norbornene
1641	CH(C2H3)3	trivinyl methane	tvm
1642	C6H10O	cyclohexanone	chexo
1643	C6H12O	hexanal	c6h12o
1644	C6H12O	Oxepane	oxepane
1645	C3H7OC3H7	di-n-propyl ether	propr
1646	F2CCCF2	tetrafluoroallene	pfa
1647	CF3COO-	trifluoro acetate anion	cf3coo-
1648	CF3COF	trifluoroacetyl fluoride	cf3cof
1649	CF3COCl	trifluoroacetyl chloride	cf3cocl
1650	PF6	Hexafluorophosphate neutral	pf6
1651	PF6-	Hexafluorophosphate ion	pf6-
1652	SF6	Sulfur Hexafluoride	sf6
1653	SeF6	Selenium hexafluoride	sef6
1654	SF5Cl	sulfur chloropentafluoride	sf5cl
1655	CF3CHF2	pentafluoroethane	cf3chf2
1656	CF3CHFCl	1,1,1,2-tetrafluorochloroethane	cf3chfcl
1657	CF3CHCl2	1,1-Dichloro-2,2,2-trifluoroethane	cf3chcl2
1658	CHCl2CClF2	Ethane, 1,2,2-trichloro-1,1-difluoro-	chcl2cclf2
1659	CCl3CHCl2	pentachloroethane	ccl3chcl2
1660	C6H5F	Fluorobenzene	bzf
1661	C6H5Cl	chlorobenzene	bzcl
1662	C6H5Br	bromobenzene	bzbr
1663	C8H6	Calicene	calicene
1664	C6H5CCH	phenylacetylene	phac
1665	C8H6	benzocyclobutadiene	bcbd
1666	C8H6	Pentalene	pentalene
1667	C6H5CHCH2	Styrene	styrene
1668	C8H8	cubane	cubane
1669	C8H8	cyclooctatetraene	cot
1670	C6H5CH2CH3	Ethylbenzene	etbz
1671	CH3C6H4CH3	meta-xylene	mxylene
1672	CH3C6H4CH3	paraxylene	pxylene
1673	C8H14	Bicyclo[2.2.2]octane	bico222
1674	C8H16	cyclooctane	cyclooct
1675	(CH3)3CC(CH3)3	tetramethylbutane	tmb
1676	C8H18	Octane	c8h18
1677	C6H5CN	phenyl cyanide	phcn
1678	C6H12N2	Triethylenediamine	ted
1679	C4O4--	squarate dianion	c4o4--
1680	S4N4	Tetrasulfur tetranitride	s4n4
1681	S8	Octasulfur	s8
1682	C6H4O2	parabenzoquinone	pbq
1683	C4H4N2O2	Uracil	uracil
1684	C6H5CHO	benzaldehyde	benzal
1685	C6H5OCH3	Anisole	anisole
1686	C5H9NO2	Proline	proline
1687	C6H12O2	Methyl pivalate	c598981
1688	C6H12O2	Hexanoic acid	hexa
1689	C4F4	tetrafluorcyclobutadiene	c4f4
1690	Al2Cl6	Aluminum, di-μ-chlorotetrachlorodi-	al2cl6
1691	CF3CF2Cl	pentafluorochloroethane	cf3cf2cl
1692	CF2ClCF2Cl	1,2-Dichloro-1,1,2,2-tetrafluoroethane	cf2clcf2cl
1693	CF3CFCl2	1,1-Dichlorotetrafluoroethane	cf3cfcl2
1694	CF2ClCFCl2	Ethane, 1,1,2-trichloro-1,2,2-trifluoro-	cf2clcfcl2
1695	CF3CCl3	1,1,1-trifluoro-2,2,2-trichloroethane	cf3ccl3
1696	C2Cl6	hexachloroethane	c2cl6
1697	IF7	Iodine heptafluoride	if7
1698	C6H4F2	metadifluorobenzene	mdfb
1699	C6H4F2	orthodifluorobenzene	odfb
1700	C6H4F2	1,4-difluorobenzene	pdfb
1701	C6H4Cl2	1,2-dichlorobenzene	dcb12
1702	C6H4Cl2	1,3-dichlorobenzene	dcb13
1703	C6H4Cl2	1,4-dichlorobenzene	dcb14
1704	C6H5NO	nitrosobenzene	bzno
1705	C9H8	Indene	indene
1706	C9H8	spiro[4.4]nona-1,3,6,8-tetraene	snt
1707	C9H12	n-propyl benzene	prbz
1708	C9H20	Nonane	nonane
1709	C(CN)4	tetracyanomethane	c5n4
1710	C5H4N4	purine	purine
1711	C8H7N	Indole	indole
1712	C3H3N3O3	cyanuric acid	cyanuric
1713	C6H5NO2	Nitrobenzene	c6h5no2
1714	C6H5COOH	benzoic acid	benzo
1715	CH3COC6H5	acetophenone	acph
1716	C3Cl3N3	1,3,5-Triazine, 2,4,6-trichloro-	c3cl3n3
1717	C3F6	hexafluoropropene	c3f6
1718	C6H3F3	Benzene trifluoride 123	bzf3a
1719	C8H18O	1-Octanol	octanol
1720	C10H8	Azulene	azu
1721	C10H8	naphthalene	naph
1722	C10H10	bullvalene	bullv
1723	C10H16	adamantane	adamantane
1724	C6N4	Tetracyanoethylene	tcne
1725	C6N4-	tetracyanoethylene anion	tcne-
1726	C10H22	Decane	decane
1727	C4F6	perfluorobutadiene	c4f6
1728	SF5CF3	Sulfur, pentafluoro(trifluoromethyl)-	sf5cf3
1729	C3F8	perfluoropropane	c3f8
1730	Fe(CO)5	Iron pentacarbonyl	ipc
1731	Fe(C5H5)2	ferrocene	fecp2
1732	B12H12--	Dodecahydrododecaborate(2-)	b12h12--
1733	B12H12--	Dodecahydrododecaborate(2-)	b12h12--
1734	C12H8	Acenaphthylene	acenaph
1735	C12H8	biphenylene	biph
1736	C12H10	biphenyl	biphenyl
1737	C12H10	Heptalene	heptalene
1738	C6H12O6	Inositol	inositol
1739	C6F6	hexafluorobenzene	c6f6
1740	S2F10	disulphur decafluoride	s2f10
1741	C13H10	Fluorene	fluorene
1742	C14H10	Anthracene	anth
1743	C14H10	Phenanthrene	phenanthrene
1744	C14H14	Bibenzyl	bibenzyl
1745	C12H10N2	azobenzene	azobenzene
1746	C6H5COC6H5	benzophenone	benzophenone
1747	C16H10	Pyrene	pyrene
1748	C18H12	Tetracene	tetracene
1749	C19H16	Triphenylmethane	tpm
1750	C24H12	Coronene	coronene
1751	C60	Buckminsterfullerene	c60