National Institute of Standards and Technology

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

I	Introduction
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III	Calculated data
IV	Data comparisons
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VI	Input and output files
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IX	Feedback
X	Older CCCBDB versions
XII	Geometries
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XIV	Reaction data
XV	Entropy data
XVI	Bibliographic data
XVII	Ion data
XVIII	Bad calculations
XIX	Index of properties
XX	H-bond dimers
XXI	Oddities

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

List of which calculations are completed at B3LYPultrafine /6-31G

Jump to calculations not yet done

count	Species	Name	State	Conformation
1	H	Hydrogen atom	1S	Kh
2	H+	Hydrogen atom cation		Kh
3	H2	Hydrogen diatomic	1Σg	D∞h
4	He	Helium atom	1S	Kh
5	Li	Lithium atom	2S	Kh
6	Li+	Lithium atom cation	1S	Kh
7	Na	Sodium atom	2S	Kh
8	Na+	Sodium atom cation	1S	Kh
9	K	Potassium atom	2S	Kh
10	Cu	Copper atom	2S	Kh
11	LiH	Lithium Hydride	1Σ	C∞v
12	Be	Beryllium atom	1S	Kh
13	Be+	Beryllium atom cation	2S	Kh
14	Mg	Magnesium atom	1S	Kh
15	Mg+	Magnesium atom cation	2S	Kh
16	Ca	Calcium atom	1S	Kh
17	Zn	Zinc atom	1S	Kh
18	B	Boron atom	2P	Kh
19	B	Boron atom	4P	Kh
20	B+	Boron atom cation	1S	Kh
21	Al	Aluminum atom	2P	Kh
22	Al+	Aluminum atom cation	1S	Kh
23	C	Carbon atom	3P0	Kh
24	C	Carbon atom	3P1	Kh
25	C+	Carbon atom cation	2P	Kh
26	Si	Silicon atom	3P	Kh
27	Si	Silicon atom	1S	Kh
28	Si+	Silicon atom cation	2P	Kh
29	Ti	Titanium atom	3F	Kh
30	CH4	Methane	1A1	Td
31	N+	Nitrogen atom cation	3P	Kh
32	P	Phosphorus atom	4S	Kh
33	NH3	Ammonia	1A1	C3v
34	O	Oxygen atom	3S	Kh
35	O+	Oxygen atom cation	4S	Kh
36	S	Sulfur atom	3P	Kh
37	Se	Selenium atom	3P	Kh
38	OH	Hydroxyl radical	2Π	C∞v
39	H2O	Water	1A1	C2v
40	F	Fluorine atom	2P	Kh
41	F-	Fluorine atom anion	1S	Kh
42	F+	Fluorine atom cation	3S	Kh
43	Cl	Chlorine atom	2P	Kh
44	Cl-	Chlorine atom anion	1S	Kh
45	Cl+	Chlorine atom cation	3P	Kh
46	HF	Hydrogen fluoride	1Σ	C∞v
47	HCl	Hydrogen chloride	1Σ	C∞v
48	Ne	Neon atom	1S	Kh
49	Ne+	Neon atom cation	2P	Kh
50	Ar	Argon atom	1S	Kh
51	Na2	Sodium diatomic	1Σg	D∞h
52	C2H+	Ethynyl cation	1Σ	C∞v
53	C2H2	Acetylene	1Σg	D∞h
54	C2H4	Ethylene	1Ag	D2h
55	C2H6	Ethane	1A1g	D3d
56	N2	Nitrogen diatomic	1Σg	D∞h
57	CO	Carbon monoxide	1Σ	C∞v
58	NO	Nitric oxide	2Π	C∞v
59	O2	Oxygen diatomic	3Σg	D∞h
60	H2CO	Formaldehyde	1A1	C2v
61	BF	Boron monofluoride	1Σ	C∞v
62	F2	Fluorine diatomic	1Σg	D∞h
63	Cl2	Chlorine diatomic	1Σg	D∞h
64	C3H5	Allyl radical	2A2	C2v
65	C3H6	Cyclopropane	1A1'	D3h
66	CH2CHCH3	Propene	1A'	Cs
67	CO2	Carbon dioxide	1Σg	D∞h
68	SO2	Sulfur dioxide	1A1	C2v
69	BF3	Borane, trifluoro-	1A'	D3h
70	AlF3	Aluminum trifluoride	1A1'	D3h

Species NOT done yet

count	Species	Name	file name	problem
1	D	Deuterium atom	d
2	D-	Deuterium atom anion	d-
3	D+	Deuterium atom cation	d+
4	H-	Hydrogen atom anion	h-
5	D2	Deuterium diatomic	d2
6	H2-	hydrogen diatomic anion	h2-
7	H2+	Hydrogen cation	h2+
8	HD	Deuterium hydride	hd
9	H3+	hydrogen trimer cation	h3+
10	He-	Helium atom anion	he-
11	He+	Helium atom cation	he+
12	HeH	Helium hydride	heh
13	HeH+	Helium hydride cation	heh+
14	He2+	helium diatomic cation	he2+
15	Li-	Lithium atom anion	li-
16	Na-	Sodium atom anion	na-
17	K-	Potassium atom anion	k-
18	K+	Potassium atom cation	k+
19	Cu-	Copper atom anion	cu-
20	Cu+	Copper atom cation	cu+
21	LiH-	lithium hydride anion	lih-
22	LiH+	lithium hydride cation	lih+
23	NaH	sodium hydride	nah
24	NaH-	sodium hydride anion	nah-
25	NaH+	sodium hydride cation	nah+
26	KH	Potassium hydride	kh
27	KH+	Potassium hydrogen cation	kh+
28	CuH	Copper monohydride	cuh
29	Be-	Beryllium atom anion	be-
30	Mg-	Magnesium atom anion	mg-
31	Ca-	Calcium atom anion	ca-
32	Ca+	Calcium atom cation	ca+
33	Zn-	Zinc atom anion	zn-
34	Zn+	Zinc atom cation	zn+
35	BeH	beryllium monohydride	beh
36	BeH-	berylium monohydride anion	beh-
37	BeH+	beryllium monohydride cation	beh+
38	MgH	magnesium monohydride	mgh
39	MgH-	magnesium monohydride anion	mgh-
40	MgH+	magnesium monohydride cation	mgh+
41	CaH	Calcium monohydride	cah
42	CaH+	Calcium monohydride cation	cah+
43	TiH	Titanium monohydride	tih
44	ZnH	Zinc monohydride	znh
45	ZnH+	Zinc, protonated	znh+
46	BeH2	beryllium dihydride	beh2
47	BeH2+	Beryllium dihydride cation	beh2+
48	MgH2	magnesium dihydride	mgh2
49	CaH2	Calcium Hydride	cah2
50	ZnH2	Zinc hydride	znh2
51	B-	Boron atom anion	b-
52	Al-	Aluminum atom anion	al-
53	Sc	Scandium atom	sc
54	Sc+	Scandium cation	sc+
55	Ga	Gallium atom	ga
56	Ga-	Gallium atom anion	ga-
57	Ga+	Gallium atom cation	ga+
58	BH	Boron monohydride	bh
59	BH-	boron monohydride anion	bh-
60	BH+	boron monohydride cation	bh+
61	AlH	aluminum monohydride	alh
62	AlH-	aluminum monohydride anion	alh-
63	AlH+	aluminum monohydride cation	alh+
64	ScH	Scandium monohydride	sch
65	ScH+	Scandium monohydride cation	sch+
66	GaH	Gallium monohydride	gah
67	GaH+	Gallium monohydride cation	gah+
68	BH2	boron dihydride	bh2
69	BH2-	boron dihydride anion	bh2-
70	BH2+	Boron dihydride cation	bh2+
71	AlH2	aluminum dihydride	alh2
72	AlH2-	aluminum dihydride anion	alh2-
73	AlH2+	aluminum dihydride cation	alh2+
74	BH3	boron trihydride	bh3
75	BH3-	boron trihydride anion	bh3-
76	BH3+	boron trihydride cation	bh3+
77	AlH3	aluminum trihydride	alh3
78	AlH3-	aluminum trihydride anion	alh3-
79	AlH3+	aluminum trihydride cation	alh3+
80	ScH3	Scandium trihydride	sch3
81	GaH3	Gallium trihydride	gah3
82	BH4	borohydride	bh4
83	BH4-	borohydride anion	bh4-
84	AlH4-	Aluminum tetrahydride anion	alh4-
85	C-	Carbon atom anion	c-
86	Si-	Silicon atom anion	si-
87	Ti-	Titanium atom anion	ti-
88	Ti+	Titanium atom cation	ti+
89	Ge	Germanium atom	ge
90	Ge-	Germanium anion	ge-
91	Ge+	Germanium cation	ge+
92	Sn	Tin atom	sn
93	Sn+	Tin cation	sn+
94	CH	Methylidyne	ch
95	CH-	methylidyne anion	ch-
96	CH+	Methylidyne cation	ch+
97	SiH	Silylidyne	sih
98	SiH-	silicon monohydride anion	sih-
99	SiH+	silicon monohydride cation	sih+
100	GeH	germylidene	geh
101	GeH+	Germaniun monohyrdide cation	geh+
102	CH2	Methylene	ch2
103	CH2-	methylene anion	ch2-
104	CH2+	methylene cation	ch2+
105	SiH2	silicon dihydride	sih2
106	SiH2-	silicon dihydride anion	sih2-
107	SiH2+	silicon dihydride cation	sih2+
108	GeH2	germylene	geh2
109	GeH2-	germylene anion	geh2-
110	CH3	Methyl radical	ch3
111	CH3-	methyl anion	ch3-
112	CH3+	methyl cation	ch3+
113	SiH3	Silyl radical	sih3
114	SiH3-	Silyl anion	sih3-
115	SiH3+	Silyl cation	sih3+
116	GeH3	Germyl radical	geh3
117	GeH3+	germyl cation	geh3+
118	CD4	methane-d4	cd4
119	CH2D2	methane-d2	ch2d2
120	CH3D	methane-d	ch3d
121	CH4-	Methane anion	ch4-
122	CH4+	Methane cation	ch4+
123	CHD3	methane-d3	chd3
124	SiH2D2	silane-d2	sih2d2
125	SiH4	Silane	sih4
126	SiH4+	Silane cation	sih4+
127	GeH4	Germane	geh4
128	SnH4	Stannane	snh4
129	SiH5+	Silane, protonated	sih5+
130	N	Nitrogen atom	n
131	N-	Nitrogen atom anion	n-
132	P-	Phosphorus atom anion	p-
133	P+	Phosphorus atom cation	p+
134	V	Vanadium atom	v
135	V+	Vanadium atom cation	v+
136	As	Arsenic atomic	as
137	As-	Arsenic anion	as-
138	As+	Arsenic cation	as+
139	Sb	Antimony atom	sb
140	NH	Imidogen	nh
141	NH-	Imidogen anion	nh-
142	NH+	imidogen cation	nh+
143	PH	phosphorus monohydride	ph
144	PH-	phosphorus monohydride anion	ph-
145	PH+	phosphorus monohydride cation	ph+
146	AsH	Arsenic monohydride	ash
147	AsH+	Arsenic monohydride cation	ash+
148	SbH	Antimony monohydride	sbh
149	ND2	Amidogen-d2	nd2
150	NH2	Amino radical	nh2
151	NH2-	amino anion	nh2-
152	NH2+	Amino cation	nh2+
153	PH2	Phosphino radical	ph2
154	PH2-	Phosphino anion	ph2-
155	PH2+	Phosphino cation	ph2+
156	AsH2	Arsenic dihydride	ash2
157	AsH2+	Arsenic dihydride cation	ash2+
158	ND3	Ammonia-d3	nd3
159	NH3-	Ammonia anion	nh3-
160	NH3+	ammonia cation	nh3+
161	PH3	Phosphine	ph3
162	PH3+	Phosphine cation	ph3+
163	AsH3	Arsine	ash3
164	AsH3+	Arsine cation	ash3+
165	SbH3	Stibine	sbh3
166	AsH4+	Arsonium	ash4+
167	NH4	Ammonium radical	nh4
168	NH4+	ammonium cation	nh4+
169	PH4	Phosphoranyl radical	ph4
170	PH4+	phosphonium cation	ph4+
171	O-	Oxygen atom anion	o-
172	S-	Sulfur atom anion	s-
173	S+	Sulfur atom cation	s+
174	Cr	Chromium atom	cr
175	Se-	Selenium atom anion	se-
176	Se+	Selenium atom cation	se+
177	Te	Tellurium atom	te
178	Te+	Tellurium atom cation	te+
179	DO	Hydroxyl-d	od
180	OH-	hydroxide anion	oh-
181	OH+	hydoxyl cation	oh+
182	DS	Mercapto-d	ds
183	HS	Mercapto radical	hs
184	HS-	mercapto anion	sh-
185	HS+	sulfur monohydride cation	sh+
186	CrH	Chromium hydride	crh
187	CrH+	Chromium hydride cation	crh+
188	HSe	Selenium monohydride	hse
189	HSe-	selenium monohydride anion	hse-
190	HSe+	selenium monohydride cation	hse+
191	TeH	Telluryl radical	teh
192	D2O	Deuterium oxide	d2o
193	H2O-	water anion	h2o-
194	H2O+	water cation	h2o+
195	HDO	Water-d1	hdo
196	D2S	Hydrogen sulfide-d2	d2s
197	H2S	Hydrogen sulfide	h2s
198	H2S-	Hydrogen sulfide anion	h2s-
199	H2S+	Hydrogen sulfide cation	h2s+
200	H2Se	Hydrogen selenide	h2se
201	H2Se+	Hydrogen selenide cation	h2se+
202	H2Te	Hydrogen Telluride	h2te
203	H3O+	hydronium cation	h3o+
204	H3S+	Sulfonium cation	h3s+
205	H3Se+	Hydrogen Selenide, protonated	h3se+
206	Mn	Manganese atom	mn
207	Br	Bromine atom	br
208	Br-	Bromine atom anion	br-
209	Br+	Bromine atom cation	br+
210	I	Iodine atom	iodine
211	I-	Iodine atom anion	iodine-
212	I+	Iodine atom cation	iodine+
213	DF	Hydrofluoric acid-d	df
214	HF-	hydrogen fluoride anion	hf-
215	HF+	hydrogen fluoride cation	hf+
216	DCl	Hydrochloric acid-d	dcl
217	HCl-	hydrogen chloride anion	hcl-
218	HCl+	hydrogen chloride cation	hcl+
219	HBr	hydrogen bromide	hbr
220	HBr-	hydrogen bromide anion	hbr-
221	HBr+	hydrogen bromide cation	hbr+
222	HI	Hydrogen iodide	hi
223	HI+	Hydrogen iodide cation	hi+
224	H2F+	dihydrogen fluoride cation	h2f+
225	H2Cl+	dihydrogen monochloride cation	h2cl+
226	H2Br+	protonated hydrogen bromide	h2br+
227	H2I+	Iodonium	h2i+
228	Ne-	Neon atom anion	ne-
229	Ar-	Argon atom anion	ar-
230	Ar+	Argon atom cation	ar+
231	Fe	Iron atom	fe
232	Kr	Krypton atom	kr
233	Kr+	Krypton cation	kr+
234	Xe	Xenon atom	xe
235	HeLi+	Helium Lithium cation	heli+
236	NeH	neon hydrogen	neh
237	NeH+	neon hydrogen cation	neh+
238	ArH+	Argon hydride cation	arh+
239	KrH+	Protonated Krypton	krh+
240	XeH+	Xenon, protonated	xeh+
241	H2Ar	H2 Ar dimer	h2ar
242	Co	Cobalt atom	cobalt
243	Ni	Nickel atom	ni
244	Li2	Lithium diatomic	li2
245	Li2-	lithium diatomic anion	li2-
246	Li2+	lithium diatomic cation	li2+
247	NaLi	lithium sodium	lina
248	NaLi-	lithium sodium anion	lina-
249	NaLi+	lithium sodium cation	lina+
250	LiK	Lithium Potassium	lik
251	Na2-	sodium diatomic anion	na2-
252	Na2+	sodium diatomic cation	na2+
253	NaK	Sodium Potassium	nak
254	NaK+	Sodium Potassium diatomic cation	nak+
255	K2	Potassium diatomic	k2
256	Cu2	Copper diatomic	cu2
257	LiBe	Lithium Beryllium	libe
258	LiMg	Lithium magnesium	limg
259	NaBe	Sodium Beryllium	nabe
260	NaMg	Sodium Magnesium	namg
261	Be2	Beryllium diatomic	be2
262	Be2-	Beryllium diatomic anion	be2-
263	Be2+	Beryllium diatomic cation	be2+
264	BeMg	Beryllium Magnesium	bemg
265	Mg2	Magnesium diatomic	mg2
266	Mg2-	magnesium diatomic anion	mg2-
267	Mg2+	magnesium diatomic cation	mg2+
268	Ca2	Calcium diatomic	ca2
269	LiB	Lithium boride	lib
270	LiAl	Lithium Aluminum	lial
271	NaAl	Sodium aluminum	naal
272	BeB	Beryllium monoboride	beb
273	B2	Boron diatomic	b2
274	B2-	Boron diatomic anion	b2-
275	B2+	Boron diatomic cation	b2+
276	BAl	Boron Aluminum	bal
277	Al2	Aluminum diatomic	al2
278	Al2-	aluminum diatomic anion	al2-
279	Al2+	aluminum diatomic cation	al2+
280	BGa	Boron Gallium	bga
281	AlGa	Aluminum Gallium	alga
282	Ga2	Gallium diatomic	ga2
283	HBBH	Diborane(2)	hbbh
284	LiBH4	Lithium borohydride	libh4
285	B2H4	Diborane(4) D2d	b2h4
286	HBHHBH	Diborane(4) C2V	hbhhbh
287	B2H6	Diborane	b2h6
288	B2H6+	Diborane cation	b2h6
289	Al2H6	dialane	al2h6
290	Ga2H6	digallane	ga2h6
291	LiC	Lithium Carbide	lic
292	BeC	Beryllium Carbide	bec
293	CaC	Calcium monocarbide	cac
294	BC	boron monocarbide	bc
295	BC-	boron monocarbide anion	bc-
296	BC+	boron monocarbide cation	bc+
297	AlC	Aluminum carbide	alc
298	BSi	Boron silicide	bsi
299	C2	Carbon diatomic	c2
300	C2-	carbon diatomic anion	c2-
301	C2+	carbon diatomic cation	c2+
302	SiC	silicon monocarbide	sic
303	SiC-	silicon monocarbide anion	sic-
304	SiC+	silicon monocarbide cation	sic+
305	Si2	Silicon diatomic	si2
306	Si2-	silcon diatomic anion	si2-
307	Si2+	silcon diatomic cation	si2+
308	GeC	Germanium monocarbide	gec
309	SiGe	Silicon Germanium	sige
310	Ge2	Germanium diatomic	ge2
311	C2H	Ethynyl radical	c2h
312	C2H-	Ethynyl anion	c2h-
313	C2H+	Ethynyl cation	c2h+
314	ZnCH2	Zinc methylene	znch2
315	C2H2+	acetylene cation	c2h2+
316	CCH2	vinylidene	vinylidene
317	H2CC-	vinylidene anion	h2cc-
318	HCCH-	acetylene anion	c2h2-
319	Si2H2	disilyne	si2h2
320	CH3Li	methyl lithium	ch3li
321	CuCH3	monomethyl copper	cuch3
322	ZnCH3	Zinc monomethyl	znch3
323	CH2BH	methyleneborane	ch2bh
324	C2H3	vinyl	c2h3
325	C2H3-	vinyl anion	c2h3-
326	C2H3+	vinyl cation	c2h3+
327	C2H4-	Ethylene anion	c2h4-
328	C2H4+	Ethylene cation	c2h4+
329	CH3CH	methylmethylene	ch3ch
330	CH2SiH2	silaethylene	ch2sih2
331	Si2H4	Disilene	si2h4
332	CH3BH2	methylborane	ch3bh2
333	C2H5	Ethyl radical	c2h5
334	C2H5-	Ethyl anion	c2h5-
335	C2H5+	Ethyl cation	c2h5+
336	C2H6+	ethane cation	c2h6+
337	CH3SiH3	methyl silane	ch3sih3
338	Si2H6	disilane	si2h6
339	GeH3CH3	methyl germane	geh3ch3
340	C2H7+	Ethane, protonated	c2h7+
341	LiN	Lithium Nitride	lin
342	LiN+	Lithium Nitride cation	lin+
343	LiP	Lithium monophosphide	lip
344	BeN	Beryllium mononitride	ben
345	BeN-	Beryllium mononitride anion	ben-
346	BeN+	Beryllium mononitride cation	ben+
347	MgN	Magnesium Nitride	mgn
348	BN-	boron nitride anion	bn-
349	AlN-	aluminum mononitride anion	aln-
350	AlN+	aluminum mononitride cation	aln+
351	BP	Boron monophosphide	bp
352	AlP	Aluminum monophosphide	alp
353	GaN	Gallium mononitride	gan
354	GaP	Gallium monophosphide	gap
355	GaAs	Gallium arsenide	gaas
356	BN	boron nitride	bn
357	BN+	boron nitride cation	bn+
358	AlN	Aluminum nitride	aln
359	CN	Cyano radical	cn
360	CN-	cyanide anion	cn-
361	CN+	Cyano cation	cn+
362	CP	Carbon monophosphide	cp
363	CP-	carbon monophosphide anion	cp-
364	CP+	carbon monophosphide cation	cp+
365	SiN	Silicon nitride	sin
366	SiN-	silicon mononitride anion	sin-
367	SiN+	silicon mononitride cation	sin+
368	SiP	Silicon monophosphide	sip
369	SiP-	Silicon monophosphide anion	sip-
370	SiP+	Silicon monophosphide cation	sip+
371	TiN	Titanium mononitride	tin
372	N2-	nitrogen diatomic anion	n2-
373	N2+	diatomic nitrogen cation	n2+
374	PN	Phosphorus mononitride	pn
375	PN-	phosphorus nitride anion	pn-
376	PN+	phosphorus nitride cation	pn+
377	P2	Phosphorus diatomic	p2
378	P2-	phosphorus diatomic anion	p2-
379	P2+	phosphorus diatomic cation	p2+
380	AsN	Arsenic mononitride	asn
381	AsP	Arsenic monophosphide	asp
382	SbN	Antimony nitride	sbn
383	As2	Arsenic diatomic	as2
384	HNB	hydrogen nitrogen boron	hnb
385	HNC	hydrogen isocyanide	hnc
386	HCN	Hydrogen cyanide	hcn
387	HCN-	Hydrogen cyanide anion	hcn-
388	HCN+	hydrogen cyanide cation	hcn+
389	HNC+	hydrogen isocyanide cation	hnc+
390	HCP	Phosphaethyne	hcp
391	HCP+	Phosphaethyne cation	hcp+
392	NNH	Dinitrogen monohydride	nnh
393	NNH+	Dinitrogen monohydride cation	nnh+
394	HPO	Hydrogen phosphorus oxide	hpo
395	HPO+	Hydrogen phosphorus oxide cation	hpo+
396	LiNH2	lithium amide	linh2
397	HBNH	Boranimine	hbnh
398	CNH2	Aminomethylidyne radical	cnh2
399	CNH2+	N-protonated hydrogen isocyanide	cnh2+
400	H2CN	Dihydrogen cyanide radical	h2cn
401	H2CN+	hydrocyanonium cation	h2cn+
402	HCNH	methyleneazane	hcnh
403	HCNH+	N-protonated HCN	hcnh+
404	H2NN	Isodiazene	h2nn
405	N2H2	(E)-diazene	n2h2
406	N2H2	(Z)-Diazene	n2h2z
407	N2H2+	trans-diazene cation	n2h2+
408	CH2NH	Methanimine	ch3n
409	CH2NH+	Methanimine cation	ch2nh+
410	CHNH2	aminomethylene	chnh2
411	CHNH2+	Aminocarbene cation	chnh2+
412	CH2PH	Phosphaethene	ch3p
413	BH2NH2	Boranamine	bh2nh2
414	CH2NH2+	methyleneamine cation	ch2nh2+
415	N2H4	Hydrazine	n2h4
416	N2H4+	hydrazine cation	n2h4+
417	P2H4	Diphosphine	p2h4
418	CH3NH2	methyl amine	ch3nh2
419	CH3NH2+	methyl amine cation	ch3nh2+
420	CH3PH2	Methyl phosphine	ch3ph2
421	SiH3NH2	Silane, amino	sih3nh2
422	N2H5+	protonated hydrazine	n2h5+
423	BH3PH3	borane phosphine	bh3ph3
424	BH3NH3	borane ammonia	bh3nh3
425	CH3NH3	methyl ammonium radical	ch3nh3
426	CH3NH3+	protonated methylamine	ch3nh3+
427	CH3PH3+	methyl phosphine, protonated	ch3ph3+
428	NH3NH3	Ammonia Dimer	nh3nh3
429	N2H7+	ammonia ammonium dimer	n2h7+
430	LiO	lithium oxide	lio
431	LiO-	lithium oxide anion	lio-
432	LiO+	lithium oxide cation	lio+
433	LiS	Lithium monosulfide	lis
434	LiS+	Lithium sulfide cation	lis+
435	NaO	sodium monoxide	nao
436	NaO-	sodium oxide anion	nao-
437	NaO+	sodium oxide cation	nao+
438	KO	Potassium monoxide	ko
439	KO+	Potassium monoxide cation	ko+
440	NaS	Sodium sulfide	nas
441	CuO	Copper Monoxide	cuo
442	LiSe	Lithium monoselenide	lise
443	BeO	beryllium oxide	beo
444	BeO-	Beryllium monoxide anion	beo-
445	BeO+	Beryllium monoxide cation	beo+
446	BeS	beryllium sulfide	bes
447	MgO	magnesium oxide	mgo
448	MgO-	magnesium oxide anion	mgo-
449	MgO+	magnesium oxide cation	mgo+
450	CaO	Calcium monoxide	cao
451	MgS	magnesium sulfide	mgs
452	MgS-	magnesium sulfide anion	mgs-
453	MgS+	magnesium sulfide cation	mgs+
454	CaS	Calcium sulfide	cas
455	ZnO	zinc monoxide	zno
456	ZnS	Zinc sulfide	zns
457	BeS-	Beryllium monosulfide anion	bes-
458	BeS+	Beryllium monosulfide cation	bes+
459	BO	boron monoxide	bo
460	BO-	boron monoxide anion	bo-
461	AlO	Aluminum monoxide	alo
462	AlO-	Aluminum monoxide anion	alo-
463	AlO+	aluminum monoxide cation	alo+
464	BS	boron sulfide	bs
465	BS-	boron monosulfide anion	bs-
466	BS+	boron monosulfide cation	bs+
467	AlS	Aluminum sulfide	als
468	AlS-	aluminum monosulfide anion	als-
469	AlS+	aluminum monosulfide cation	als+
470	ScO	Scandium monoxide	sco
471	GaO	Gallium monoxide	gao
472	GaS	Gallium monosulfide	gas
473	BO+	boron monoxide cation	bo+
474	CO-	carbon monoxide anion	co-
475	CO+	carbon monoxide cation	co+
476	CS	carbon monosulfide	cs
477	CS-	carbon monosulfide anion	cs-
478	CS+	carbon monosulfide cation	cs+
479	SiO	Silicon monoxide	sio
480	SiO-	silicon monoxide anion	sio-
481	SiO+	silicon monoxide cation	sio+
482	SiS	silicon monosulfide	sis
483	SiS-	silicon monosulfide anion	sis-
484	SiS+	silicon monosulfide cation	sis+
485	TiO	Titanium monoxide	tio
486	CSe	Carbon monoselenide	cse
487	CSe-	Carbon monoselenide anion	cse-
488	CSe+	Carbon monoselenide cation	cse+
489	GeO	Germanium monoxide	geo
490	GeO+	Germanium monoxide cation	geo+
491	GeS	Germanium monosulfide	ges
492	SiSe	Silicon Monoselenide	sise
493	SiSe+	Silicon Monoselenide cation	sise+
494	GeSe	Germanium monoselenide	gese
495	NO-	nitric oxide anion	no-
496	NO+	nitric oxide cation	no+
497	NS	Mononitrogen monosulfide	ns
498	NS-	nitrogen sulfide anion	ns-
499	NS+	nitrogen sulfide cation	ns+
500	PO	Phosphorus monoxide	po
501	PO-	phosphorus monoxide anion	po-
502	PO+	phosphorus monoxide cation	po+
503	PS	phosphorus sulfide	ps
504	PS-	phosphorus monosulfide anion	ps-
505	PS+	phosphorus monosulfide cation	ps+
506	VO	Vanadium monoxide	vo
507	AsO	Arsenic monoxide	aso
508	NSe	Nitrogen monoselenide	nse
509	AsS	Arsenic monosulfide	ass
510	PSe	Phosphorus monoselenide	pse
511	AsSe	Arsenic monoselenide	asse
512	O2-	oxygen diatomic anion	o2-
513	O2--	dioxygen dianion	o2--
514	O2+	diatomic oxygen cation	o2+
515	SO	Sulfur monoxide	so
516	SO-	sulfur monoxide anion	so-
517	SO+	sulfur monoxide cation	so+
518	S2	Sulfur diatomic	s2
519	S2-	sulfur diatomic anion	s2-
520	S2+	sulfur diatomic cation	s2+
521	SeO	Selenium monoxide	seo
522	SeO-	selenium monoxide anion	seo-
523	SeO+	selenium monoxide cation	seo+
524	SeS	Selenium monosulfide	ses
525	SeS-	selenium monosulfide anion	ses-
526	SeS+	selenium monosulfide cation	ses+
527	TeO	Tellurium monoxide	teo
528	Se2	Selenium diatomic	se2
529	Se2-	selenium diatomic anion	se2-
530	Se2+	selenium diatomic cation	se2+
531	Te2	Tellurium diatomic	te2
532	LiOH	lithium hydroxide	lioh
533	NaOH	sodium hydroxide	naoh
534	KOH	Potassium hydroxide	koh
535	BeOH	beryllium monohydroxide	beoh
536	MgOH	magnesium hydroxide	mgoh
537	CaOH	Calcium monohydroxide	caoh
538	HBO	Boron hydride oxide	hbo
539	HBS	hydrogen boron sulfide	hbs
540	COH	Hydroxymethylidyne	coh
541	COH+	Carbon Monoxide, protonated	coh+
542	HCO	Formyl radical	hco
543	HCO-	formyl anion	hco-
544	HCO+	Formyl cation	hco+
545	HCS	Thioformyl radical	hcs
546	HCS-	Thioformyl anion	hcs-
547	HCS+	Thioformyl cation	hcs+
548	HNO	Nitrosyl hydride	hno
549	HNO-	Nitrosyl hydride anion	hno-
550	HNO+	Nitrosyl hydride cation	hno+
551	NOH	Hydroxyimidogen	noh
552	NOH+	O-protonated nitric oxide	noh+
553	HNS	Sulfur imide	hns
554	HNS-	Sulfur imide anion	hns-
555	HO2	Hydroperoxy radical	ho2
556	HO2-	Hydroperoxy anion	ho2-
557	HO2+	Hydroperoxy cation	ho2+
558	HSO+	Sulfur Monoxide, S-protonated	HSO+
559	SOH	Sulfur Hydroxide	soh
560	SOH+	Sulfur Monoxide, protonated	soh+
561	HS2	Thiosulfeno radical	hs2
562	H2CO-	formaldehyde anion	h2co-
563	H2CO+	formaldehyde cation	h2co+
564	HOCH	hydroxycarbene	hoch
565	H2CS	Thioformaldehyde	h2cs
566	H2CS-	thioformaldehyde anion	h2cs-
567	H2CS+	thioformaldehyde cation	h2cs+
568	H2CSe	Selenoformaldehyde	h2cse
569	H2NO	nitroxide	h2no
570	H2O2	Hydrogen peroxide	h2o2
571	H2O2+	Hydrogen peroxide cation	h2o2+
572	H2OO	water oxide	h2oo
573	HOSH	hydrogen thioperoxide	hosh
574	H2S2	Disulfane	h2s2
575	H2S2+	hydrogen disulfide cation	h2s2+
576	H2Se2	hydrogen diselenide	h2se2
577	CH2OH	Hydroxymethyl radical	ch2oh
578	CH2OH+	hydroxymethyl cation	ch2oh+
579	CH3O	Methoxy radical	ch3o
580	CH3O-	methoxy anion	ch3o-
581	CH3O+	Methoxy cation	ch3o+
582	CH3S	thiomethoxy	ch3s
583	H2CSH+	Thioformaldehyde, protonated	h2csh+
584	NH2OH	hydroxylamine	nh2oh
585	NH2OH+	Hydroxylamine cation	nh2oh+
586	NH3O	Ammonia Oxide	nh3o
587	H2POH	Phosphinous acid	h2poh
588	H3PO	Phosphine oxide	h3po
589	NH2SH	Thiohydroxylamine	nh2sh
590	NH3S	sulfidoazane	nh3s
591	H3O2+	hydrogen peroxide, protonated	h3o2+
592	CH3OH	Methyl alcohol	ch3oh
593	CH3OH-	Methyl alcohol anion	ch3oh-
594	CH3OH+	Methyl alcohol cation	ch3oh+
595	CH3SH	Methanethiol	ch3sh
596	CH3SH+	Methanethiol cation	ch3sh+
597	SiH3OH	silanol	sih3oh
598	CH3SeH	Methane selenol	ch3seh
599	NH2OH2+	protonated hydroxylamine	nh2oh2+
600	NH3OH+	N-protonated hydroxylamine	nh3oh+
601	H2OH2O	water dimer	h2oh2o
602	CH3OH2+	Methanol, protonated	ch3oh2+
603	CH3SH2+	protonated methylsulfide	ch3sh2+
604	H2ONH3	Water Ammonia Dimer	h2onh3
605	H5O2+	Dihydroxonium ion	h5o2+
606	LiF	lithium fluoride	lif
607	LiCl	lithium chloride	licl
608	LiCl-	lithium chloride anion	licl-
609	LiCl+	lithium chloride cation	licl+
610	NaF	sodium fluoride	naf
611	NaF-	sodium fluoride anion	naf-
612	NaF+	sodium fluoride cation	naf+
613	KF	Potassium Fluoride	kf
614	NaCl	Sodium Chloride	nacl
615	NaCl-	sodium chloride anion	nacl-
616	NaCl+	sodium chloride cation	nacl+
617	KCl	Potassium Chloride	kcl
618	CuF	Copper monofluoride	cuf
619	LiBr	Lithium Bromide	libr
620	LiBr-	lithium bromide anion	libr-
621	LiBr+	lithium bromide cation	libr+
622	CuCl	Copper monochloride	cucl
623	NaBr	Sodium Bromide	nabr
624	NaBr-	sodium bromide anion	nabr-
625	NaBr+	sodium bromide cation	nabr+
626	KBr	Potassium Bromide	kbr
627	LiI	Lithium Iodide	lii
628	NaI	Sodium Iodide	nai
629	KI	Potassium Iodide	ki
630	LiF-	lithium fluoride anion	lif-
631	LiF+	lithium fluoride cation	lif+
632	BeF	Beryllium monofluoride	bef
633	BeF-	Beryllium monofluoride anion	bef-
634	BeF+	Beryllium monofluoride cation	bef+
635	BeCl	beryllium monochloride	becl
636	MgF	Magnesium monofluoride	mgf
637	MgF-	magnesium fluoride anion	mgf-
638	MgF+	magnesium fluoride cation	mgf+
639	CaF	Calcium monofluoride	caf
640	MgCl	magnesium monochloride	mgcl
641	MgCl-	magnesium monochloride anion	mgcl-
642	MgCl+	magnesium monochloride cation	mgcl+
643	CaCl	calcium monochloride	cacl
644	TiCl	Titanium Monochloride	ticl
645	ZnF	Zinc monofluoride	znf
646	ZnF-	Zinc monofluoride anion	znf-
647	ZnF+	Zinc monofluoride cation	znf+
648	ZnCl	Zinc monochloride	zncl
649	CaBr	Calcium monobromide	cabr
650	BeCl-	beryllium monochloride anion	becl-
651	BeCl+	beryllium monochloride cation	becl+
652	BF-	Boron monofluoride anion	bf-
653	BF+	Boron monofluoride cation	bf+
654	AlF	Aluminum monofluoride	alf
655	AlF-	Aluminum monofluoride anion	alf-
656	AlF+	Aluminum monofluoride cation	alf+
657	BCl	boron monochloride	bcl
658	BCl-	boron monochloride anion	bcl-
659	BCl+	boron monochloride cation	bcl+
660	AlCl	Aluminum monochloride	alcl
661	AlCl-	aluminum monochloride anion	alcl-
662	AlCl+	aluminum monochloride cation	alcl+
663	ScF	Scandium monofluoride	scf
664	BBr	Boron monobromide	bbr
665	GaF	Gallium monofluoride	gaf
666	GaF+	Gallium monofluoride cation	gaf+
667	AlBr	Aluminum monobromide	albr
668	GaCl	Gallium monochloride	gacl
669	GaCl+	Gallium monochloride cation	gacl+
670	AlI	Aluminum monoiodide	ali
671	GaBr	Gallium monobromide	gabr
672	CF	Fluoromethylidyne	cf
673	CF-	carbon monofluoride anion	cf-
674	CF+	carbon monofluoride cation	cf+
675	CCl	carbon monochloride	ccl
676	CCl-	carbon monochloride anion	ccl-
677	CCl+	carbon monochloride cation	ccl+
678	SiF	silicon monofluoride	sif
679	SiF-	silicon monofluoride anion	sif-
680	SiF+	silicon monofluoride cation	sif+
681	SiCl	Clorosilylidyne	sicl
682	SiCl-	silicon monochloride anion	sicl-
683	SiCl+	silicon monochloride cation	sicl+
684	CBr	Carbon monobromide	cbr
685	GeF	Germanium monofluoride	gef
686	GeF+	Germanium monofluoride cation	gef+
687	GeCl	Germanium monochloride	gecl
688	GeCl+	Germanium monochloride cation	gecl+
689	SiBr	Silicon monobromide	sibr
690	SiBr+	Silicon monobromide cation	sibr+
691	NF	nitrogen fluoride	nf
692	NF-	nitrogen monofluorine anion	nf-
693	NF+	nitrogen monofluoirde cation	nf+
694	NCl	nitrogen monochloride	ncl
695	NCl-	nitrogen monochloride anion	ncl-
696	NCl+	nitrogen monochloride cation	ncl+
697	PF	phosphorus monofluoride	pf
698	PF-	phosphorus monofluoride anion	pf-
699	PF+	phosphorus monofluoride cation	pf+
700	PCl	phosphorus chloride	pcl
701	PCl-	phosphorus monochloride anion	pcl-
702	PCl+	phosphorus monochloride cation	pcl+
703	AsF	Arsenic monofluoride	asf
704	NBr	nitrogen monobromide	nbr
705	AsCl	Arsenic monochloride	ascl
706	PBr	Phosphorus monobromide	pbr
707	SbF	Antimony monofluoride	sbf
708	SbCl	Antimony monochloride	sbcl
709	FO	Oxygen monofluoride	fo
710	FO-	flourine oxide anion	fo-
711	FO+	fluorine monoxide cation	fo+
712	ClO	Monochlorine monoxide	clo
713	ClO-	chlorine monoxide anion	clo-
714	ClO+	chlorine monoxide cation	clo+
715	SF	Monosulfur monofluoride	sf
716	SF-	sulfur monofluoride anion	sf-
717	SF+	sulfur monofluoride cation	sf+
718	SCl	sulfur monochloride	scl
719	SCl-	sulfur monochloride anion	scl-
720	SCl+	sulfur monochloride cation	scl+
721	BrO	Bromine monoxide	bro
722	BrO-	Bromine monoxide anion	bro-
723	BrO+	Bromine monoxide cation	bro+
724	SeF	Selenium monofluoride	sef
725	SBr	Sulfur monobromide radical	sbr
726	SBr+	Sulfur monobromide cation	sbr+
727	SeCl	Selenium monochloride	secl
728	IO	Iodine monoxide	io
729	SeBr	Selenium monobromide	sebr
730	BrCl	Bromine monochloride	brcl
731	F2-	flourine diatomic anion	f2-
732	F2+	flourine diatomic cation	f2+
733	ClF	Chlorine monofluoride	clf
734	ClF-	clorine monofluoride anion	clf-
735	ClF+	clorine monofluoride cation	clf+
736	Cl2-	chlorine diatomic anion	cl2-
737	Cl2+	chlorine diatomic cation	cl2+
738	BrF	Bromine monofluoride	brf
739	BrF-	bromine fluoride anion	brf-
740	BrF+	bromine fluoride cation	brf+
741	BrCl-	bromine chloride anion	brcl-
742	BrCl+	bromine chloride cation	brcl+
743	IF	Iodine monofluoride	if
744	Br2	Bromine diatomic	br2
745	Br2-	bromine diatomic anion	br2-
746	Br2+	bromine diatomic cation	br2+
747	ICl	Iodine monochloride	icl
748	IBr	Iodine monobromide	ibr
749	I2	Iodine diatomic	i2
750	I2+	Iodine diatomic cation	i2+
751	HCF	Fluoromethylene	hcf
752	HCCl	Chloromethylene	hccl
753	HSiF	fluorosilylene	hsif
754	HSiCl	Chlorosilylene	hsicl
755	HSiBr	monobromosilylene	hsibr
756	CHBr	bromomethylene	chbr
757	HOF	Hypofluorous acid	hfo
758	DOCl	Hypochlorous acid-d	docl
759	HOCl	hypochlorous acid	hocl
760	HOCl+	hypochlorous acid cation	hocl+
761	HOBr	Hypobromous acid	hobr
762	HOBr+	Hypobromous acid cation	hobr+
763	HOI	Hypoiodous acid	hoi
764	F2H+	Fluorine, protonated	f2h+
765	FHF	Hydrogen difluoride	fhf
766	FHF-	Hydrogen difluoride anion	fhf-
767	ClFH+	Chlorine fluoride, F-protonated	clfh+
768	FClH+	Chlorine fluoride, Cl-protonated	fclh+
769	Cl2H+	Chlorine, protonated	cl2h+
770	CH2Br	bromomethyl radical	ch2br
771	CH2F	fluoromethyl radical	ch2f
772	CH2F+	fluoromethyl cation	ch2f+
773	CH2Cl+	chloromethyl cation	ch2cl+
774	CH2Cl	chloromethyl radical	ch2cl
775	NH2F	monofluoroamine	nh2f
776	NH2Cl	chloramine	nh2cl
777	H2F2	Hydrogen fluoride dimer	h2f2
778	CH3F+	methyl fluoride cation	ch3f+
779	CD3F	methylfluoride-d3	cd3f
780	CH3F	Methyl fluoride	ch3f
781	CD3Cl	methyl chloride d3	cd3cl
782	CH3Cl	Methyl chloride	ch3cl
783	CH3Cl+	Methyl chloride cation	ch3cl+
784	SiH3F	monofluorosilane	sih3f
785	SiH3Cl	chlorosilane	sih3cl
786	CH3Br	methyl bromide	ch3br
787	GeH3F	monofluorogermane	geh3f
788	GeH3Cl	monochlorogermane	geh3cl
789	SiH3Br	bromosilane	sih3br
790	CH3I	methyl iodide	ch3i
791	SiH3I	Silyl Iodide	sih3i
792	NH3Cl+	protonated monochloroammonia	nh3cl+
793	CH3ClH+	methyl chloride, protonated	ch3clh+
794	NH4Cl	Ammonium chloride	nh4cl
795	LiNe+	Lithium Neon cation	line+
796	Ne2	Neon diatomic	ne2
797	Ne2+	Neon diatomic cation	ne2+
798	Ar2	Argon diatomic	ar2
799	Ar2+	Argon diatomic cation	ar2+
800	Li3	Lithium trimer	li3
801	Li3+	Lithium trimer cation	li3+
802	C3	carbon trimer	c3
803	C3+	carbon trimer cation	c3+
804	SiC2	Silicon dicarbide	sic2
805	C3H3	cyclopropenyl radical	cpr
806	C3H3	Propargyl radical	propargyl
807	C3H3-	Propargyl anion	c3h3-
808	C3H3+	cyclopropenyl cation	cpr+
809	C3H3+	Propargyl cation	c3h3+
810	C3H4	cyclopropene	cprop
811	CH2CCH2	allene	allene
812	CH3CCH	propyne	propyne
813	C3H5+	Allyl cation	allyl+
814	CH3CHCH	1-propenyl radical	ch3chch
815	Zn(CH3)2	dimethyl zinc	dmz
816	C3H7	n-Propyl radical	npropyl
817	C3H7+	cyclopropane, protonated	c3h7+
818	CH3CHCH3	Isopropyl radical	isopropyl
819	CH3CHCH3+	Isopropyl cation	prop2yl+
820	C3H8	Propane	propane
821	SiH2(CH3)2	dimethylsilane	dms
822	Si3H8	trisilane	si3h8
823	LiCN	lithium cyanide	licn
824	NaCN	Sodium Cyanide	nacn
825	KCN	Potassium cyanide	kcn
826	CuCN	Copper cyanide	cucn
827	ZnCN	Zinc monocyanide	zncn
828	ZnNC	Zinc isocyanide	znnc
829	AlCN	Aluminum monocyanide	alcn
830	AlNC	Aluminum isocyanide	alnc
831	CN2	3H-Diazirin-3-ylidene	cn2
832	CNN	Diazocarbene	cnn
833	NCN	Cyanoimidogen	ncn
834	N3	azide radical	n3
835	N3-	azide anion	n3-
836	N3+	azide cation	n3+
837	HCCN	cyanomethylene	hccn
838	HCNN	diazomethyl radical	hcnn
839	HN3	hydrogen azide	hn3
840	HN3+	Hydrazoic acid cation	hn3+
841	HNCNH	diiminomethane	hncnh
842	CH2N2	diazirine	ch2n2
843	CH2NN	diazomethane	ch2nn
844	NH2CN	cyanamide	cyanamide
845	HNNNH+	1,2-Triazadienium	n2h3+
846	NH2NN+	hydrazoic acid, protonated	nh2nn+
847	CH3CN	Acetonitrile	ch3cn
848	CH3CN-	acetonitrile anion	ch3cn-
849	CH3CN+	Acetonitrile cation	ch3cn+
850	CH3NC	methyl isocyanide	ch3nc
851	CHNCH2	2H-Azirine	c157164
852	CHNHCH	1H-Azirine	chnhch
853	H2CCNH	Ethenimine	ch2cnh
854	H2CNCH	methyleneaminomethylene	ch2nch
855	HCCNH2	Ethynamine	hccnh2
856	HCNCH2+	2H-Azirine cation	hcnch2+
857	HNCNH2+	diiminomethane, protonated	hncnh2+
858	NCNH3+	Cyanamide, protonated	ncnh3+
859	NH2CNH+	cyanamide, cn protonated	nh2cnh+
860	NH3CN+	cyanamide, amine protonated	nh3cn+
861	CH2CHNH	vinylazine	ch2chnh
862	CH3CHN	methylmethaniminyl radical	ch3chn
863	NHCHNH2	aminomethanimine	cn2h4
864	C2H5N	Aziridine	c2h5n
865	CH2CHNH2	aminoethene	aminoethene
866	CH2NCH3	N-methylmethanimine	nmm
867	CH3CHNH	ethanimine	ethanimine
868	NH2BHNH2	diaminoborane	nh2bhnh2
869	C2H5NH+	Protonated Aziridine	c2h5nh+
870	C2H6N+	aziridine, protonated	c2h6n+
871	NH2CH2NH2	diaminomethane	nh2ch2nh2
872	CH3CH2NH2	Ethylamine	etam
873	CH3NHCH3	Dimethylamine	ch3nhch3
874	CH3PHCH3	dimethylphosphine	ch3phch3
875	NH2CH2NH3+	diaminoethane, protonated	pdam
876	(CH3)2NH2+	dimethylammonium cation	dmam
877	CH3CH2NH3+	ethylamine, protonated	pea
878	Li2O	dilithium oxide	li2o
879	Li2O+	dilithium oxide cation	li2o+
880	Li2S	dilithium sulfide	li2s
881	Na2O	disodium monoxide	na2o
882	Na2S	Sodium sulfide	na2s
883	LiO2	Lithium dioxide	lio2
884	NaO2	Sodium superoxide	nao2
885	CCO	Dicarbon monoxide	cco
886	CNO-	fulminate	cno-
887	NCO	isocyanato radical	nco
888	NCO-	cyanate	nco-
889	SCN	thiocyanato radical	scn
890	SCN-	thiocyanide anion	scn-
891	BO2	Boron dioxide	bo2
892	BO2-	Boron dioxide anion	bo2-
893	BO2+	Boron dioxide cation	bo2+
894	N2O	Nitrous oxide	n2o
895	N2O-	Nitrous oxide anion	n2o-
896	N2O+	Nitrous oxide cation	n2o+
897	NNS	Nitrogen sulfide	nns
898	PPO	Phosphorus oxide phosphide	ppo
899	CO2-	Carbon dioxide anion	co2-
900	CO2+	Carbon dioxide cation	co2+
901	OCS	Carbonyl sulfide	cos
902	OCS+	Carbonyl sulfide cation	cos+
903	SiO2	silicon dioxide	sio2
904	CS2	Carbon disulfide	cs2
905	CS2-	Carbon disulfide anion	cs2-
906	CS2+	Carbon disulfide cation	cs2+
907	TiO2	Titanium dioxide	tio2
908	SiS2	Silicon disulfide	sis2
909	GeO2	Germanium dioxide	geo2
910	OCSe	Carbonyl selenide	ocse
911	SCSe	Carbon sulfide selenide	scse
912	GeS2	Germanium disulfide	ges2
913	CSe2	Carbon diselenide	cse2
914	SCTe	Carbon sulfide Telluride	scte
915	NO2	Nitrogen dioxide	no2
916	NO2-	Nitrogen dioxide anion	no2-
917	NO2+	Nitrogen dioxide cation	no2+
918	NSO	sulfinyl amidogen	NSO
919	PO2	Phosphorus dioxide	po2
920	PO2-	Phosphorus dioxide anion	po2-
921	PO2+	Phosphorus dioxide cation	po2+
922	SNO	Nitrogen oxide sulfide	sno
923	AsO2	Aresenic dioxide	aso2
924	O3	Ozone	o3
925	O3-	Ozone anion	o3-
926	O3+	Ozone cation	o3+
927	SO2-	Sulfur dioxide anion	so2-
928	SO2+	Sulfur dioxide cation	so2+
929	SSO	Disulfur monoxide	sso
930	S3	Sulfur trimer	s3
931	S3-	Sulfur trimer anion	s3-
932	S3+	Sulfur trimer cation	s3+
933	SeO2	Selenium dioxide	seo2
934	SeO2+	Selenium dioxide cation	seo2+
935	TeO2	Tellurium Dioxide	teo2
936	HCCO	ketenyl radical	ketenyl
937	CS2H+	Carbon disulfide, protonated	cs2h+
938	HCNO	fulminic acid	hcno
939	HNCO	Isocyanic acid	hnco
940	HOCN	cyanic acid	hocn
941	HNCS	Isothiocyanic acid	hncs
942	HSCN	thiocyanic acid	hscn
943	HCO2-	formate anion	hco2-
944	HNNO	nitrosoazane	hnno
945	HNNO+	Nitrous oxide, N-protonated	hnno+
946	NNOH+	Nitrous Oxide, O-protonated	nnoh+
947	HCOO	formate neutral radical	hcoo
948	HOCO	Hydrocarboxyl radical	hoco
949	HOCO+	Hydrocarboxyl cation	hoco+
950	HNO2	Nitrous acid	hno2
951	HNO2+	nitrous acid cation	hno2+
952	O3H+	protonated ozone	o3h+
953	SO2H+	protonated sulfur dioxide	so2h+
954	C2H2O	Oxirene	oxirene
955	CH2CO	Ketene	ch2co
956	CH2CO+	Ketene cation	ch2co+
957	HCCOH	ethynol	hccoh
958	CH2CS	Thioketene	ch2cs
959	Be(OH)2	Beryllium hydroxide	beo2h2
960	Mg(OH)2	Magnesium dihydroxide	h2mgo2
961	NH2NO	Nitrosamide	nh2no
962	CH2O2	Dioxirane	diox
963	H2COO	Dioxymethyl radical	h2coo
964	H2COO+	dioxymethyl cation	h2coo+
965	HCOOH	Formic acid	ch2o2
966	H2O3	Hydrogen trioxide	h2o3
967	HSSSH	trisulfane	hsssh
968	NaOCH3	Sodium methoxide	naoch3
969	CH2BOH	hydroxy(methylene)borane	ch2boh
970	BH3CO	Borane carbonyl	bh3co
971	CH3BO	Borane, methyloxo-	ch3bo
972	CH2CHO	Vinyloxy radical	ch2cho
973	CH2COH+	ketene, protonated	ch2coh+
974	CH3CO	Acetyl radical	ch3co
975	CH3CO-	Acetyl anion	ch3co-
976	CH3CO+	acetyl cation	ch3co+
977	CH2NOH	formaldoxime	ch2noh
978	CH3NO	nitrosomethane	ch3no
979	CHONH2	formamide	formamide
980	CNOH3	1,2-oxaziridine	cnoh3
981	HOCHNH	hydroxymethylimine	hochnh
982	CHSNH2	thioformamide	chsnh2
983	NHCHSH	Methanimidothioic acid	nhchsh
984	CH2OOH	CH2OOH radical	ch2ooh
985	CH3OO	methylperoxy radical	ch3oo
986	CH3OO-	methylperoxy anion	ch3oo-
987	CH3OO+	methylperoxy cation	ch3oo+
988	C2H4O	Ethylene oxide	c2h4o
989	C2H4O+	ethylene oxide cation	c2h4o+
990	CH2CHOH	ethenol	ch2choh
991	CH3CHO	Acetaldehyde	ch3cho
992	CH3CHO+	acetaldehyde cation	ch3cho+
993	H2COCH2+	Methyl, (methyleneoxoniumyl)-	h2coch2+
994	C2H4S	Thiirane	thiirane
995	CH2CHSH	Ethenethiol	ch2chsh
996	CH3CHS	Thioacetaldehyde	ch3chs
997	H2CONH2+	protonated formamide	h2conh2+
998	NH2CHOH+	Formamide, O-protonated	nh2choh+
999	NH3CHO+	Formamide, N-Protonated	nh3cho+
1000	CH2(OH)2	methanediol	ch2o2h2
1001	CH3OOH	Methyl peroxide	ch3ooh
1002	CH3SSH	Hydrogen methyl disulfide	ch3ssh
1003	HSCH2SH	Methanedithiol	ch4s2
1004	H2OH2CO	water formaldehyde dimer	h2oh2co
1005	C2H4OH+	ethylene oxide, protonated	c2h4oh+
1006	CH2CH2OH	2-hydroxy ethyl radical	ch2ch2oh
1007	CH3CH2O	Ethoxy radical	ethoxy
1008	CH3CHOH	1-hydroxy-ethyl radical	ch3choh
1009	CH3CHOH+	acetaldehyde, protonated	ch3choh+
1010	CH3OCH2	methoxymethyl radical	ch3och2
1011	NH2CH2OH	aminomethanol	nh2ch2oh
1012	CH3CH2OH	Ethanol	etoh
1013	CH3OCH3	Dimethyl ether	meome
1014	CH3CH2SH	ethanethiol	etsh
1015	CH3SCH3	Dimethyl sulfide	mesme
1016	CH3SCH3+	dimethyl sulfide cation	mesme+
1017	CH3SeCH3	dimethylselenide	dmse
1018	CH3OHH2O	methanol water dimer	ch3ohh2o
1019	H2OCH3OH	water methanol dimer	h2och3oh
1020	CuF2	Copper difluoride	cuf2
1021	ZnF2	Zinc difluoride	znf2
1022	CNF	iso cyanogen fluoride	cnf
1023	FCN	Cyanogen fluoride	fcn
1024	ClCN	chlorocyanogen	clcn
1025	BrCN	Cyanogen bromide	brcn
1026	ICN	Cyanogen iodide	icn
1027	FBO	Boron monofluoride monoxide	fbo
1028	BeF2	Beryllium fluoride	bef2
1029	MgF2	Magnesium fluoride	mgf2
1030	BeCl2	Beryllium chloride	becl2
1031	MgCl2	Magnesium dichloride	mgcl2
1032	CaCl2	Calcium Chloride	cacl2
1033	ZnCl2	Zinc dichloride	zncl2
1034	BeBr2	Beryllium bromide	bebr2
1035	CaBr2	Calcium dibromide	cabr2
1036	CaF2	Calcium difluoride	caf2
1037	FCO	Carbonyl fluoride	fco
1038	FCO+	Carbonyl fluoride cation	fco+
1039	ClCO	carbonyl monochloride	clco
1040	BF2	Boron difluoride radical	bf2
1041	FNO	Nitrosyl fluoride	fno
1042	ClNO	Nitrosyl chloride	clno
1043	FNS	Thionitrosyl fluoride	fns
1044	FSN	Thiazyl fluoride	fsn
1045	OPCl	Phosphorus oxychloride	opcl
1046	BrNO	Nitrosyl bromide	brno
1047	INO	Nitrosyl iodide	ino
1048	CF2	Difluoromethylene	cf2
1049	CF2-	Difluoromethylene anion	cf2-
1050	CF2+	Difluoromethylene cation	cf2+
1051	CFCl	chlorofluoromethylene	cfcl
1052	SiF2	Silicon difluoride	sif2
1053	SiF2+	Silicon difluoride cation	sif2+
1054	CCl2	dichloromethylene	ccl2
1055	CCl2-	dichloromethylene anion	ccl2-
1056	CCl2+	dichloromethylene cation	ccl2+
1057	SiCl2	Dichlorosilylene	sicl2
1058	GeF2	Germanium difluoride	gef2
1059	GeCl2	Germanium dichloride	gecl2
1060	CBr2	dibromomethylene	cbr2
1061	FOO	Dioxygen monofluoride radical	foo
1062	FOO+	Fluorine dioxide cation	foo+
1063	ClOO	chloroperoxy radical	cloo
1064	ClOO+	chloroperoxy cation	cloo+
1065	OClO	Chlorine dioxide	oclo
1066	OClO-	Chlorine dioxide anion	oclo-
1067	OClO+	Chlorine dioxide cation	oclo+
1068	ClSO	Sulfur chloride oxide	clso
1069	ClS2	Sulfur chloride	cls2
1070	BrOO	Bromine dioxide	broo
1071	OBrO	Bromine dioxide radical	obro
1072	NF2	Difluoroamino radical	nf2
1073	NF2+	Difluoroamino cation	nf2+
1074	PF2	Phosphorus difluoride	pf2
1075	PF2+	Phosphorus difluoride cation	pf2+
1076	FClO	chlorosyl fluoride	fclo
1077	F2O	Difluorine monoxide	f2o
1078	ClOF	Chlorine hypofluorite	clof
1079	SF2	sulfur difluoride	sf2
1080	SF2-	sulfur difluoride anion	sf2-
1081	SF2+	sulfur difluoride cation	sf2+
1082	Cl2O	Dichlorine monoxide	cl2o
1083	SCl2	Sulfur dichloride	scl2
1084	SeF2	Selenium difluoride	sef2
1085	BrOCl	Bromine hypochlorite	brocl
1086	SeCl2	Selenium Dichloride	secl2
1087	SBr2	Sulfur dibromide	sbr2
1088	SeBr2	Selenium dibromide	sebr2
1089	BrOBr	Bromine oxide	brobr
1090	F3-	trifluoride anion	f3-
1091	Cl3-	trichloride anion	cl3-
1092	Br3-	tribromide anion	br3-
1093	I3-	triiodide	i3-
1094	SFCl	Sulfur chloride fluoride	sfcl
1095	HCCF	Fluoroacetylene	hccf
1096	HCCF+	fluoroacetylene cation	hccf+
1097	HCCCl	Chloroacetylene	hcccl
1098	HCCBr	bromoacetylene	hccbr
1099	HFCO	formyl fluoride	hfco
1100	HFCO+	formyl fluoride cation	hfco+
1101	COHCl	Formyl chloride	cohcl
1102	COHBr	Formyl bromide	cohbr
1103	BHF2	Difluoroborane	bhf2
1104	BHCl2	Borane, dichloro-	bhcl2
1105	CHCl2	dichloromethyl radical	chcl2
1106	CHF2	difluoromethyl radical	chf2
1107	CHF2+	difluoromethyl cation	chf2+
1108	CHFCl	Chlorofluoromethyl radical	chfcl
1109	CHFCl+	Chlorofluoromethyl cation	chfcl+
1110	CHCl2+	dichloromethyl cation	chcl2+
1111	CHBr2	dibromomethyl radical	chbr2
1112	HOClO	Chlorous acid	hoclo
1113	NHF2	difluoramine	nhf2
1114	NHCl2	dichloroamine	nhcl2
1115	CH2F2	Methane, difluoro-	ch2f2
1116	CH2FCl	fluorochloromethane	ch2fcl
1117	SiH2F2	difluorosilane	sih2f2
1118	CH2Cl2	Methylene chloride	ch2cl2
1119	CH2BrF	Methane, bromofluoro-	ch2fbr
1120	CH2BrCl	Methane, bromochloro-	ch2clbr
1121	CH2FI	fluoroiodomethane	ch2fi
1122	CH2Br2	dibromomethane	ch2br2
1123	CH2ClI	chloroiodomethane	ch2cli
1124	CH2BrI	bromoiodomethane	ch2bri
1125	CH2I2	Diiodomethane	ch2i2
1126	SiH2Cl2	dichlorosilane	sih2cl2
1127	CH3MgBr	Methyl Magnesium Bromide	ch3mgbr
1128	CH2CHF	Ethene, fluoro-	ch2chf
1129	CH2CHF+	fluoroethene cation	ch2chf+
1130	C2H3Cl	Ethene, chloro-	ch2chcl
1131	C2H3Br	vinyl bromide	c2h3br
1132	C2H3I	Vinyl iodide	c2h3i
1133	CH2FOH	fluoromethanol	ch2foh
1134	CH3OCl	methyl hypochlorite	ch3ocl
1135	CH2CH2Cl	2-chloroethyl radical	ch2ch2cl
1136	CHClCH3	1-chloroethyl radical	chclch3
1137	C2H5F	fluoroethane	c2h5f
1138	CH3CH2Cl	Ethyl chloride	c2h5cl
1139	CH3SiFH2	fluoromethylsilane	ch3sifh2
1140	C2H5Br	Ethyl bromide	etbr
1141	C2H5I	Ethyl iodide	c2h5i
1142	KrF2	Krypton difluoride	krf2
1143	XeF2	Xenon difluoride	xef2
1144	B4H10	Tetraborane(10)	b4h10
1145	C4	Carbon tetramer	c4
1146	C4+	Carbon tetramer cation	c4+
1147	C4H2	Diacetylene	c4h2
1148	C4H2+	diacetlyene cation	c4h2+
1149	C2H3CCH	1-Buten-3-yne	c2h3cch
1150	C4H4	cyclobutadiene	cbd
1151	C4H4	Tetrahedrane	c4h4
1152	H2CCCCH2	Butatriene	h2cccch2
1153	C4H6	1-Methylcyclopropene	c3100047
1154	C4H6	Cyclobutene	c822355
1155	C4H6	Methylenecyclopropane	c6142730
1156	CH2CCHCH3	1,2-Butadiene	butad12
1157	CH2CHCHCH2	1,3-Butadiene	c106990
1158	CH3CCCH3	2-Butyne	c503173
1159	CHCCH2CH3	1-Butyne	c107006
1160	CH3CHCHCH2	methylallyl radical	c4h7
1161	C4H8	methylcyclopropane	mcp
1162	CH2C(CH3)CH3	1-Propene, 2-methyl-	isobute
1163	CH2CHCH2CH3	1-Butene	bute1
1164	CH3CHCHCH3	2-Butene, (E)-	bute2e
1165	CH3CHCHCH3	2-Butene, (Z)-	bute2z
1166	B(CH3)3	trimethylborane	bme3
1167	Al(CH3)3	trimethyl aluminum	tma
1168	C(CH3)3	Tert-butyl radical	tbutyl
1169	CH2CH(CH3)2	Isobutyl radical	isobutyl
1170	CH3CHCH2CH3	2-Butyl radical	butyl2
1171	CH3CH(CH3)CH3	Isobutane	isobutane
1172	CH3CH2CH2CH3	Butane	butane
1173	SiH(CH3)3	trimethylsilane	trimsi
1174	Li3N	trilithium nitride	li3n
1175	C2N2	Cyanogen	c2n2
1176	C2N2+	Cyanogen cation	c2n2+
1177	P4	Phosphorus tetramer	p4
1178	As4	Arsenic tetramer	as4
1179	HCCCN	Cyanoacetylene	hcccn
1180	HCCCN+	Cyanoacetylene cation	hcccn+
1181	H2CNCN	cyanamide, methylene	ch2ncn
1182	HNCCNH	Ethenediimine	hnccnh
1183	C3H3N	acrylonitrile	ch2chcn
1184	C3H3N+	acrylonitrile cation	ch2chcn+
1185	CH3N3	methyl azide	ch3n3
1186	NH2CCNH2	Diaminoacetylene	daa
1187	NH2CH2CN	Aminoacetonitrile	aan
1188	CH3NHN2+	methyl azide, protonated	ch3nhn2+
1189	C2H5CN	ethyl cyanide	c2h5cn
1190	CH5N3	Guanidine	guanidine
1191	C4H6	Bicyclo[1.1.0]butane	c157335
1192	CH3NNCH3	(Z)-1,2-Dimethyldiazene	dmdiazz
1193	H2NCHCHNH2	diaminoethylene	dae
1194	CH6N3+	guanidinium	ch6n3+
1195	C3H7N	Cyclopropylamine	cpram
1196	CH7N3	triaminomethane	tam
1197	C3H7N	Azetidine	azet
1198	C4H8	cyclobutane	cbutane
1199	C2H8N2	Ethylenediamine	ethdiam
1200	CH3NHNHCH3	dimethyl hydrazine	dmh
1201	CH3CH(NH2)CH3	2-Propanamine	pram2
1202	N(CH3)3	Trimethylamine	trimeam
1203	NH2CH2CH2CH3	1-Propanamine	pram1
1204	P(CH3)3	trimethylphosphine	tmp
1205	N(SiH3)3	trisilylamine	tsa
1206	As(CH3)3	trimethyl arsine	tmas
1207	(CH3)3NH+	protonated trimethyl amine	ptma
1208	C3H7NH3+	n-propylamine, protonated	c3h7nh2
1209	Li2O2	dilithium dioxide	li2o2
1210	Na2O2	disodium dioxide	na2o2
1211	K2O2	dipotassium dioxide	k2o2
1212	C3O	Tricarbon monoxide	c3o
1213	B2O2	Diboron dioxide	b2o2
1214	ONNO	NO dimer	onno
1215	S2N2	Disulfur dinitride	s2n2
1216	CO3	Carbon trioxide	co3
1217	CO3--	carbonate	co3--
1218	CS3--	Carbonotrithioate	cs3--
1219	NO3	Nitrogen trioxide	no3
1220	NO3-	nitrate anion	no3-
1221	NO3+	nitrogen trioxide cation	no3+
1222	SO3	Sulfur trioxide	so3
1223	SO3-	Sulfur trioxide anion	so3-
1224	SO3--	Sulfate dianion	so3--
1225	SO3+	Sulfur trioxide cation	so3+
1226	SeO3	selenium trioxide	seo3
1227	S4	Sulfur tetramer	s4
1228	TeO3	Tellurium trioxide	teo3
1229	HCO3-	bicarbonate anion	hco3-
1230	HNO3	Nitric acid	hno3
1231	HSO3	Hydroxysulfonyl radical	hso3
1232	NH2NO2	nitramide	nh2no2
1233	C2H2CO	cyclopropenone	c2h2co
1234	C3H2O	Propadienal	c3h2o
1235	HCCCHO	2-propynal	hcccho
1236	C2H2O2	Ethanedial	c2h2o2
1237	C2H2O2+	Ethanedial cation	c2h2o2+
1238	H2CO3	Carbonic acid	h2co3
1239	H2CS3	thiocarbonic acid	h2cs3
1240	H2NO3+	Nitric Acid, Protonated	h2no3+
1241	H2SO3	Sulfurous acid	h2so3
1242	C2H3NO	Nitrosoethylene	c2h3no
1243	CH3NCO	methylisocyante	ch3nco
1244	HOCH2CN	cyanomethanol	hoch2cn
1245	CH3COO-	acetate anion	ch3coo-
1246	CH3NO2	Methane, nitro-	ch3no2
1247	CH3ONO	Methyl nitrite	ch3ono
1248	NH2COOH	Carbamic acid	nh2cooh
1249	H3BO3	Boric acid	h3bo3
1250	H3AlO3	Aluminum hydroxide	h3alo3
1251	H3CO3+	carbonic acid, protonated	h3co3+
1252	C3H4O	2-Propyn-1-ol	c107197
1253	C3H4O	allenol	c9000071
1254	C3H4O	Cyclopropanone	cpone
1255	C3H4O	Methylketene	c6004440
1256	CH2CHCHO	Acrolein	c3h4o
1257	NH2CONH2	Urea	urea
1258	NH2CONH2+	Urea cation	urea+
1259	NH2CSNH2	Thiourea	thiourea
1260	C2H4O2	1,3-dioxetane	c2h4o2
1261	CH3COOH	Acetic acid	ch3cooh
1262	CH3OCHO	methyl formate	ch3ocho
1263	CHOCH2OH	hydroxy acetaldehyde	haa
1264	NH2COOH2+	Carbamic acid, O-protonated	nh2cooh2+
1265	NH3COOH+	protonated Carbamic acid	nh3cooh+
1266	H2OHCOOH	Water formic acid dimer 1	h2ohcooh_10
1267	H2OHCOOH	Water formic acid dimer 2	h2ohcooh_11
1268	HCOOHH2O	Formic acid water dimer	hcoohh2o
1269	HOCH2OOH	hydroxy methyl peroxide	hoch2ooh
1270	CH3COCH2	Acetonyl radical	ch3coch2
1271	CH2C(OH)NH2	1-amino vinyl alchohol	ava
1272	CH3C(OH)=NH	Ethaninidic acid	eia
1273	CH3CHNOH	Acetaldoxime	acetaldoxime
1274	CH3CONH2	Acetamide	acetamide
1275	HCONHCH3	N-methylformamide	nmfa
1276	CH3CSNH2	Ethanethioamide	ch3csnh2
1277	CH5N2O+	urea, N-protonated	ch4n2o+
1278	H2NCOHNH2+	urea, protonated	ureah+
1279	C2H5OO	ethylperoxy radical	c2h5oo
1280	CH3NNCH3	(E)-1,2-Dimethyldiazene	dmdiaze
1281	C3H5OH	Cyclopropanol	cproh
1282	C3H6O	2-Propen-1-ol	c107186
1283	C3H6O	Acetone enol	enol
1284	C3H6O	Oxetane	oxetane
1285	C3H6O	Propylene oxide	prox
1286	CH3CH2CHO	Propanal	propanal
1287	CH3COCH3	Acetone	acetone
1288	CH3COCH3-	acetone anion	ch3coch3-
1289	C3H6S	Thietane	thietane
1290	C3H6S	Thiirane, methyl-	methiirane
1291	CH3CSCH3	Thioacetone	ch3csch3
1292	C2H6O2	1,2-Ethanediol	ethdiol
1293	CH3OOCH3	dimethylperoxide	dmp
1294	CH3SOCH3	Dimethyl sulfoxide	dmso
1295	CH2SHCH2SH	1,2-Ethanedithiol	ethdisl
1296	CH3SSCH3	Disulfide, dimethyl	ch3ssch3
1297	CH3COHCH3+	acetone, protonated	acetoneh+
1298	HOCH2CH2NH2	monoethanolamine	mea
1299	C3H7OH	1-Propanol	proh
1300	CH3CHOHCH3	Isopropyl alcohol	isoproh
1301	CH3OC2H5	Ethane, methoxy-	etome
1302	C3H7SH	1-Propanethiol	prsh
1303	CH3CHSHCH3	2-Propanethiol	isoprsh
1304	CH3SCH2CH3	Ethane, (methylthio)-	etsme
1305	H2OCH3OCH3	water dimethylether dimer	h2och3och3
1306	Li2F2	Lithium fluoride dimer	li2f2
1307	Na2F2	Sodium Fluoride Dimer	na2f2
1308	Na2Cl2	Disodium dichloride	na2cl2
1309	C2F2	difluoroacetylene	c2f2
1310	C2Cl2	dichloroacetylene	c2cl2
1311	C2Cl2+	dichloroacetylene cation	c2cl2+
1312	FNO2	Nitryl fluoride	fno2
1313	FONO	Nitrosyl hypofluorite	fono
1314	ClNO2	Nitryl chloride	clno2
1315	ClONO	chlorine nitrite	clono
1316	BrONO	Bromine nitrite	brono
1317	N2F2	(Z)-Difluorodiazene	n2f2_z
1318	N2F2	Dinitrogen difluoride, (E)-	n2f2_e
1319	CF2O	Carbonic difluoride	f2co
1320	CF2O+	Carbonic difluoride cation	f2co+
1321	COFCl	Carbonic chloride fluoride	cofcl
1322	CCl2O	Phosgene	cl2co
1323	Cl2CS	Thiophosgene	cl2cs
1324	COBr2	Carbonic dibromide	cobr2
1325	BF3-	Borane, trifluoro- anion	bf3-
1326	BF3+	boron trifluoride cation	bf3+
1327	BClF2	Chlorodifluoroborane	bclf2
1328	AlF2Cl	Aluminum chloride difluoride	alclf2
1329	ScF3	Scandium trifluoride	ScF3
1330	AlFCl2	Aluminum dichloride fluoride	alcl2f
1331	BCl3	Borane, trichloro-	bcl3
1332	BCl3+	Boron Trichloride cation	bcl3+
1333	GaF3	Gallium trifluoride	gaf3
1334	AlCl3	Aluminum trichloride	alcl3
1335	GaCl3	Gallium trichloride	gacl3
1336	BBr3	Boron tribromide	bbr3
1337	AlBr3	Aluminum Bromide	albr3
1338	ClO3	Chlorine trioxide	clo3
1339	ClO3-	chlorate anion	clo3-
1340	BrO3-	Bromate anion	bro3-
1341	CF3	Trifluoromethyl radical	cf3
1342	CF3-	Trifluoromethyl anion	cf3-
1343	CF3+	Trifluoromethyl cation	cf3+
1344	CF2Cl	difluorochloromethyl radical	cf2cl
1345	SiF3	Silicon trifluoride radical	sif3
1346	SiF3+	Silicon trifluoride cation	sif3+
1347	CFCl2	dichlorofluoromethyl radical	cfcl2
1348	CCl3	Trichloromethyl radical	ccl3
1349	CCl3-	Trichloromethyl anion	ccl3-
1350	CCl3+	Trichloromethyl cation	ccl3+
1351	SiCl3	trichlorosilyl radical	sicl3
1352	SiCl3+	trichlorosilyl cation	sicl3+
1353	CBr3	tribromomethyl radical	cbr3
1354	FOOF	Perfluoroperoxide	foof
1355	ClO2F	Chloryl fluoride	clo2f
1356	F2SO	Thionyl Fluoride	f2so
1357	ClOOCl	Dichlorine dioxide	cloocl
1358	FSSF	Difluorodisulfane	fssf
1359	S2F2	Thio-thionyl fluoride	s2f2
1360	SOCl2	thionyl chloride	socl2
1361	SSCl2	Thiothionyl chloride	sscl2
1362	SeOCl2	selenium oxychloride	seocl2
1363	NF3	Nitrogen trifluoride	nf3
1364	NF3-	Nitrogen trifluoride anion	nf3-
1365	NF3+	Nitrogen trifluoride cation	nf3+
1366	PF3	Phosphorus trifluoride	pf3
1367	NCl3	nitrogen trichloride	ncl3
1368	AsF3	Arsenic trifluoride	asf3
1369	PCl3	Phosphorus trichloride	pcl3
1370	SbF3	Antimony Trifluoride	sbf3
1371	AsCl3	Arsenous trichloride	ascl3
1372	SbCl3	Antimony Trichloride	sbcl3
1373	NBr3	Nitrogen Tribromide	nbr3
1374	PBr3	Phosphorus tribromide	pbr3
1375	AsBr3	Arsenic tribromide	asbr3
1376	NI3	Nitrogen triiodide	ni3
1377	PI3	Phosphorus triiodide	pi3
1378	ClSSCl	Disulfur dichloride	s2cl2
1379	SF3	Sulfur trifluoride	sf3
1380	ClF3	Chlorine trifluoride	clf3
1381	BrF3	Bromine trifluoride	brf3
1382	IF3	iodone trifluoride	if3
1383	HClO3	Chloric Acid	hclo3
1384	CHF3	Methane, trifluoro-	chf3
1385	CHF2Cl	difluorochloromethane	chf2cl
1386	SiHF3	trifluorosilane	sihf3
1387	CHFCl2	fluorodichloromethane	chfcl2
1388	CDCl3	trichloromethane-d	cdcl3
1389	CHCl3	Chloroform	chcl3
1390	CHBrF2	Methane, bromodifluoro-	chbrf2
1391	SiHCl3	Trichlorosilane	sihcl3
1392	CHFClBr	fluorochlorobromomethane	chfclbr
1393	CHBrCl2	Methane, bromodichloro-	chbrcl2
1394	CHF2I	difluoroiodomethane	chf2i
1395	CHBr2F	dibromofluoromethane	chbr2f
1396	CHFClI	fluorochloroiodomethane	chfcli
1397	CHCl2I	dichloroiodomethane	chcl2i
1398	CHClBr2	Methane, dibromochloro-	chclbr2
1399	CHBr3	bromoform	chbr3
1400	CHI3	Iodoform	chi3
1401	NF3H+	protonated nitrogen trifluoride	nf3h+
1402	AsF3H+	Arsenic trifluoride, protonated	asf3h+
1403	C2H2F2	Ethene, 1,2-difluoro-, (E)-	c2h2f2e
1404	C2H2F2	Ethene, 1,2-difluoro-, (Z)-	c2h2f2z
1405	CH2CF2	Ethene, 1,1-difluoro-	ch2cf2
1406	C2H2ClF	1-chloro-1-fluoroethylene	c2h2clf
1407	CHFCHCl	(E)-1-chloro-2-fluoroethene	chfchcle
1408	CHFCHClz	(Z)-1-Chloro-2-fluoroethene	chfchclz
1409	CH2CCl2	Ethene, 1,1-dichloro-	ch2ccl2
1410	CHClCHCl	Ethene, 1,2-dichloro-, (E)-	chclchcle
1411	CHClCHCl	Ethene, 1,2-dichloro-, (Z)-	chclchclz
1412	C2H2Br2	1,1-dibromoethene	c2h2br2
1413	CHBrCHBr	Ethene, 1,2-dibromo-, (E)-	chbrchbre
1414	CHBrCHBr	Ethene, 1,2-dibromo-, (Z)-	chbrchbrz
1415	CH2FCHO	Fluoroacetaldehyde	ch2fcho
1416	CH3COF	Acetyl fluoride	ch3cof
1417	CH2ClCHO	chloroacetaldehyde	ch2clcho
1418	CH3COCl	Acetyl Chloride	ch3cocl
1419	C2H4F2	1,2-difluoroethane	c2h4f2
1420	CH3CHF2	Ethane, 1,1-difluoro-	ch3chf2
1421	CH2FCH2Cl	Ethane, 1-chloro-2-fluoro-	ch2fch2cl
1422	CH3CHFCl	Ethane, 1-chloro-1-fluoro-	ch3chfcl
1423	CH2ClCH2Cl	Ethane, 1,2-dichloro-	ch2clch2cl
1424	CH3CHCl2	Ethane, 1,1-dichloro-	ch3chcl2
1425	CH2BrCH2Cl	1-bromo-2-chloroethane	ch2brch2cl
1426	CH2BrCH2Br	Ethane, 1,2-dibromo-	ch2brch2br
1427	CH2CFCH3	2-fluoropropene	2fpro
1428	CH2CHCH2F	Allyl Fluoride	allylf
1429	CH3CHCHF	trans-1-Fluoro-1-propene	propene1ft
1430	C3H5Cl	1-Propene, 3-chloro-	prop1cl3
1431	C3H5Cl	1-chloro-1-propene(E)	prop1cl1e
1432	C3H5Cl	1-chloro-1-propene(Z)	prop1cl1z
1433	CH2FCH2OH	2-fluoroethanol	ch2fch2oh
1434	CH2ClCH2OH	2-Chloroethanol	ch2clch2oh
1435	CH2ClCH2OH2+	2-chloroethanol, protonated	ch2clch2oh2+
1436	CH2FCH2CH3	1-Fluoropropane	prf1
1437	CH3CHFCH3	2-Fluoropropane	prf2
1438	CH2ClCH2CH3	Propane, 1-chloro-	prcl1
1439	CH3CHClCH3	Propane, 2-chloro-	prcl2
1440	CH3CH2CH2Br	n-propyl bromide	prbr
1441	CH3CHBrCH3	i-propyl bromide	iprbr
1442	C3H9O+	trimethyl oxonium cation	c3h9o+
1443	B5H9	pentaborane9	b5h9
1444	C5H4	pentatetraene	ptrene
1445	C5H5	cyclopentadienyl radical	c5h5
1446	C5H5-	cylopentadienyl anion	c5h5-
1447	C5H6	1,3-Cyclopentadiene	c542927
1448	C5H6	1-Buten-3-yne, 2-methyl-	c78808
1449	C5H6	3-Penten-1-yne, (E)-	c2004695
1450	C5H6	3-Penten-1-yne, (Z)-	c1574409
1451	C5H6	Bicyclo[2.1.0]pent-2-ene	c5164352
1452	C5H6	Cyclopropylacetylene	c6746947
1453	C5H6	Propellane	propellane
1454	C5H7	1,3-pentadienyl radical	pdyl
1455	C5H7	cyclopentenyl radical	cpyl
1456	C5H8	1,2-Butadiene, 3-methyl-	c598254
1457	C5H8	1,2-Pentadiene	c591957
1458	C5H8	1,3-Butadiene, 2-methyl-	c78795
1459	C5H8	1,3-Pentadiene, (E)-	c2004708
1460	C5H8	1,3-Pentadiene, (Z)-	c1574410
1461	C5H8	1,4-Pentadiene	c591935
1462	C5H8	1-pentyne	a1pentyne
1463	C5H8	2,3-Pentadiene	c591968
1464	C5H8	Bicyclo[1.1.1]pentane	bcp
1465	C5H8	Cyclobutane, methylene-	c1120565
1466	C5H8	Cyclopentene	c142290
1467	C5H8	Ethenylcyclopropane	c693867
1468	CH3CCCH2CH3	2-Pentyne	2pentyne
1469	C5H10	1-Butene, 2-methyl-	c563462
1470	C5H10	2-Butene, 2-methyl-	c513359
1471	C5H10	2-Pentene, (E)-	c646048
1472	C5H10	2-Pentene, (Z)-	c627203
1473	C5H10	Cyclopentane	c287923
1474	C5H10	Cyclopropane, 1,1-dimethyl-	c1630940
1475	CH2CHCH2CH2CH3	1-pentene	pentene
1476	C5H11	2-Methylbut-2-yl radical	c4348350
1477	C5H12	Butane, 2-methyl-	buta2
1478	C5H12	Pentane	pentane
1479	C5H12	Propane, 2,2-dimethyl-	neopentane
1480	Si(CH3)4	tetramethylsilane	tms
1481	N2O3	Dinitrogen trioxide	n2o3
1482	C3H2N2	Malononitrile	c3h2n2
1483	CH2N4	1H-Tetrazole	1htz
1484	C3H3N2	imidazolyl radical	im
1485	C3H3N2-	imidizolyl anion	im-
1486	C2H3N3	1H-1,2,4-Triazole	c288880
1487	C4H4N	pyrrolide radical	c4h4n
1488	C4H4N-	pyrrolide anion	c4h4n-
1489	C3H4N2	1H-Imidazole	1himidaz
1490	C3H4N2	1H-Pyrazole	1hpyraz
1491	C3H4N2	2H-Imidazole	imid2h
1492	C3H4N2	4H-Imidazole	imid4h
1493	C4H5N	(E)-2-Butenenitrile	c627269
1494	C4H5N	(Z)-2-Butenenitrile	c1190767
1495	C4H5N	2H-pyrrole	pyrrole2
1496	C4H5N	3H-pyrrole	pyrrole3
1497	C4H5N	Cyclopropanecarbonitrile	c5500210
1498	C4H5N	Pyrrole	pyrrole
1499	CH2CHCH2CN	Allylcyanide	ch2chch2cn
1500	C4H6N+	pyrrole, alpha-protonated	appyr
1501	C4H6N+	pyrrole, beta-protonated	bppyr
1502	C4H6N+	pyrrole, protonated	ppyr
1503	C3H6N2	3-Aminopropionitrile	c151188
1504	CH3CH(CH3)CN	Propanenitrile, 2-methyl-	c4h7n
1505	CH3CH2CH2CN	Butanenitrile	c109740
1506	C5H8	Bicyclo[2.1.0]pentane	c185944
1507	C5H8	Spiropentane	c157404
1508	C4H9N	Cyclobutylamine	cbam
1509	C4H9N	Pyrrolidine	pyrrolidine
1510	C3H10N2	1,2-Diaminopropane	diampr12
1511	C(CH3)3NH2	2-Propanamine, 2-methyl-	c75649
1512	C(NH2)H2C(CH3)HCH3	1-Propanamine, 2-methyl-	c78819
1513	C(NH2)H2CH2CH2CH3	1-Butanamine	butam1
1514	CH3C(NH2)HCH2CH3	2-Butanamine	butam2
1515	NH(C2H5)2	diethylamine	dea
1516	NC4H12+	tetramethyl ammonium cation	nc4h12+
1517	C3O2	Carbon suboxide	c3o2
1518	C3O2+	Carbon suboxide cation	c3o2+
1519	B2O3	diboron trioxide	b2o3
1520	MgCO3	Magnesium Carbonate	mgco3
1521	BeCO3	Beryllium Carbonate	beco3
1522	CaCO3	Calcium Carbonate	caco3
1523	ONONO	Nitrosyl nitrite	onono
1524	PO4---	phosphate	po4---
1525	SO4--	sulfate	so4--
1526	HOONO2	peroxy nitric acid	hoono2
1527	HSO4-	bisulfate anion	hso4-
1528	C2H2N2S	1,3,4-Thiadiazole	c2h2n2s
1529	C3H2O2	Propiolic acid	c3h2o2
1530	CHOCOOH	oxo acetic acid	oaa
1531	CHOOCHO	diformyl ether	choocho
1532	H2SO4	Sulfuric acid	h2so4
1533	H2SeO4	Selenic acid	h2seo4
1534	C3H3NO	Isoxazole	isox
1535	C3H3NO	Oxazole	oxazole
1536	C3H3NS	Thiazole	thiazole
1537	CH3C(O)OO	acetyl peroxy radical	ch3coo2
1538	CH3NO3	Methyl nitrate	ch3no3
1539	H3PO4	Phosphoric Acid	h3po4
1540	C4H4O	Furan	furan
1541	C4H4O+	Furan cation	furan+
1542	CH3COCCH	3-butyn-2-one	c1423605
1543	C4H4S	Thiophene	furans
1544	C4H4Se	selenophene	c4h4se
1545	C3H4O2	β–Propiolactone	beta
1546	C3H4O2	2-Propenoic acid	propenoic2
1547	C3H4O2	Methyl glyoxal	megly
1548	C3H4O2	propanedial	propanedial
1549	C3H4O2	propenalol	propenalol
1550	HOCHCCHOH	allenediol	aldiol
1551	C2H4O3	1,2,3-trioxolane	c2h4o3
1552	C2H4O3	trioxolane124	triox
1553	HOCH2COOH	Hydroxyacetic acid	hac
1554	CH2CHCONH2	Acrylamide	c79061
1555	CH3OCH2CN	Methoxyacetonitrile	c1738369
1556	CH5N3S	Hydrazinecarbothioamide	c79196
1557	H2NCH2COOH	Glycine	glycine
1558	CH3SO2NH2	methanesulfonamide	ch3so2nh2
1559	C4H6O	cis-2-butenal	butenal2c
1560	C4H6O	Cyclobutanone	cbutone
1561	C4H6O	Furan, 2,3-dihydro-	furan23h
1562	C4H6O	Furan, 2,5-dihydro-	furan25h
1563	CH2CHOCHCH2	Vinyl ether	vinylether
1564	CHOCHCHCH3	2-Butenal	butenal2
1565	C4H6S	Thiophene, 2,3-dihydro-	thiop23h
1566	C4H6S	Thiophene, 2,5-dihydro-	thiop25h
1567	CH2CHSCHCH2	Divinyl sulfide	divis
1568	C2H6N2O	Urea, methyl-	c598505
1569	C3H6O2	1,3-Dioxolane	dioxolane
1570	CH3CH2COOH	Propanoic Acid	propanoic
1571	CH3COOCH3	methyl acetate	aame
1572	HCOOC2H5	Ethyl formate	faee
1573	C2H6O2S	Dimethyl sulfone	c67710
1574	CH3SSSCH3	dimethyl trisulfide	c2h6s3
1575	C3H7NO	dimethylformamide	dmf
1576	C3H7NO	Propanamide	propanam
1577	C2H3OC2H5	Ethene, ethoxy-	c109922
1578	C4H8O	Cyclobutanol	c2919235
1579	C4H8O	Furan, tetrahydro-	thf
1580	CH2C(CH3)OCH3	1-Propene, 2-methoxy-	pre1meo2
1581	CH3COCH2CH3	2-Butanone	buta2one
1582	CHOCH(CH3)CH3	Propanal, 2-methyl-	c78842
1583	CHOCH2CH2CH3	Butanal	butanal
1584	C4H8S	Thiophene, tetrahydro-	tht
1585	C3H8O2	1,3-Propanediol	c504632
1586	C3H8O2	Hydroperoxide, 1-methylethyl	c3031752
1587	C3H8O2	Methane, dimethoxy-	c109875
1588	C3H8O2	Propylene glycol	c57556
1589	C3H8S2	1,3-Propanedithiol	c109808
1590	C4H10O	1-Butanol	butanol1
1591	C4H10O	1-Propanol, 2-methyl-	c78831
1592	C4H10O	2-Butanol, (.+/-.)-	butanol2
1593	C4H10O	Ethanol, 1,1-dimethyl-	tbuoh
1594	C4H10O	Ethoxy ethane	etoet
1595	C4H10O	Methyl propyl ether	meopr
1596	C4H10O	Propane, 2-methoxy-	c598538
1597	C4H10O+	1-Butanol cation	butanol1+
1598	C(CH3)3SH	2-Propanethiol, 2-methyl-	tbush
1599	C2H5SC2H5	Diethyl sulfide	etset
1600	C4H9SH	1-Butanethiol	bush
1601	CH2(SH)CH(CH3)CH3	1-Propanethiol, 2-methyl-	c513440
1602	CH3C(SCH3)HCH3	Propane, 2-(methylthio)-	mesipr
1603	CH3CH(SH)CH2CH3	2-Butanethiol	butansl2
1604	FNO3	Fluorine nitrate	fno3
1605	ClONO2	Chlorine nitrate	clono2
1606	BrONO2	Bromine nitrate	brono2
1607	TiCl4	Titanium tetrachloride	ticl4
1608	ClO4-	perchlorate anion	clo4-
1609	BF4-	tetrafluoroboron anion	bf4-
1610	ClFO3	Perchloryl fluoride	clfo3
1611	SO2F2	Sulfuryl fluoride	so2f2
1612	SO2Cl2	Sulfuryl chloride	so2cl2
1613	F3NO	Nitrogen trifluoride oxide	f3no
1614	F3PO	Phosphoryl fluoride	pf3o
1615	Cl3PO	Phosphoryl chloride	pcl3o
1616	CF4	Carbon tetrafluoride	cf4
1617	CF3Cl	Methane, chlorotrifluoro-	cf3cl
1618	SiF4	Silicon tetrafluoride	sif4
1619	CF2Cl2	difluorodichloromethane	cf2cl2
1620	TiF4	Titanium tetrafluoride	tif4
1621	CFCl3	Trichloromonofluoromethane	cfcl3
1622	CF3Br	Bromotrifluoromethane	cf3br
1623	GeF4	Germanium tetrafluoride	gef4
1624	CCl4	Carbon tetrachloride	ccl4
1625	CCl4+	Carbon tetrachloride cation	ccl4+
1626	CBrClF2	Methane, bromochlorodifluoro-	cbrclf2
1627	SiCl4	Silane, tetrachloro-	sicl4
1628	CBrCl2F	bromodichlorofluoromethane	cbrcl2f
1629	CF3I	trifluoroiodomethane	cf3i
1630	CBrCl3	Methane, bromotrichloro-	cbrcl3
1631	CBr2F2	Methane, dibromodifluoro-	cbr2f2
1632	GeCl4	Germanium Tetrachloride	gecl4
1633	CBr2ClF	dibromochlorofluoromethane	cbr2clf
1634	CBr2Cl2	dibromodichloromethane	cbr2cl2
1635	CCl3I	trichloroiodomethane	ccl3i
1636	CFBr3	fluorotribromomethane	cfbr3
1637	CFClBrI	fluorochlorobromoiodomethane	cfclbri
1638	CBr3Cl	tribromochloromethane	cbr3cl
1639	CF2I2	difluorodiiodomethane	cf2i2
1640	CBr4	Carbon tetrabromide	cbr4
1641	CCl2I2	dichlorodiiodomethane	ccl2i2
1642	SiBr4	Silicon tetrabromide	sibr4
1643	CBr3I	tribromoiododmethane	cbr3i
1644	GeBr4	Germanium tetrabromide	gebr4
1645	CI4	tetraiodomethane	ci4
1646	SiI4	silicon tetraiodide	sii4
1647	ClOF3	Chlorine trifluoride oxide	clof3
1648	SF4	Sulfur tetrafluoride	sf4
1649	SeF4	Selenium tetrafluoride	sef4
1650	SCl4	Sulfur tetrachloride	scl4
1651	C2HF3	Trifluoroethylene	c2hf3
1652	C2HF3+	Trifluoroethylene cation	c2hf3+
1653	CHClCCl2	Trichloroethylene	chclccl2
1654	CHBrCF2	1-Bromo-2,2-difluoroethylene	chbrcf2
1655	HClO4	perchloric acid	hclo4
1656	HSO3F	Fluorosulfonic acid	hso3f
1657	CF3OH	trifluoromethanol	cf3oh
1658	CH2ClCCCl	1,3-dichloropropyne	ch2clcccl
1659	CHClCCHCl	1,3-dichloroallene	chclcchcl
1660	CHCl2CCH	3,3-dichloropropyne	chcl2cch
1661	CHCl2CHO	dichloroacetaldehyde	chcl2cho
1662	PF3CH2	phosphorane, trifluoromethylene-	pf3ch2
1663	CH3CF3	Ethane, 1,1,1-trifluoro-	ch3cf3
1664	CHF2CH2F	Ethane, 1,1,2-trifluoro	ch2fchf2
1665	CH3CF2Cl	1-Chloro-1,1-Difluoroethane	ch3cf2cl
1666	CH3CFCl2	1,1-Dichloro-1-fluoroethane	ch3cfcl2
1667	CH2ClCHCl2	1,1,2-trichloroethane	ch2clchcl2
1668	CH3CCl3	Ethane, 1,1,1-trichloro-	ch3ccl3
1669	SiCl3CH3	methyltrichlorosilane	sicl3ch3
1670	CH3CBr3	1,1,1-tribromoethane	ch3cbr3
1671	NH3BCl3	Amminetrichloroboron	nh3bcl3
1672	SiH3CCl3	(trichloromethyl)silane	sih3ccl3
1673	CH2CClCHCH2	1,3-Butadiene, 2-chloro-	c4h5cl
1674	C3H5ClO	Oxirane, (chloromethyl)-	c106898
1675	CH2FCH2CH2F	1,3-difluoropropane	ch2fch2ch2f
1676	CH3CF2CH3	2,2-difluoropropane	ch3cf2ch3
1677	CH2ClCH2CH2Cl	1,3-dichloropropane	prdicl13
1678	CH2ClCHClCH3	Propane, 1,2-dichloro-	prdicl12
1679	CH3CCl2CH3	Propane, 2,2-dichloro-	prdicl22
1680	CHCl2CH2CH3	1,1-dichloropropane	prdicl11
1681	SiCl2(CH3)2	dichlorodimethylsilane	sicl2me2
1682	CH2CClCH2CH3	1-Butene, 2-chloro-	bute1cl2
1683	CH2CHCH2CH2Cl	1-Butene, 4-chloro-	bute1cl4
1684	CH2CHCHClCH3	1-Butene, 3-chloro-	bute1cl3
1685	CH2ClCHCHCH3	2-Butene, 1-chloro-	bute2cl1
1686	CH3CClCHCH3	2-Butene, 2-chloro-, (E)-	bute2cl2e
1687	CH3CClCHCH3	2-Butene, 2-chloro-, (Z)-	bute2cl2z
1688	CHClCHCH2CH3	(E)-1-Chloro-1-butene	bute1cl1
1689	CHClCHCH2CH3	(Z)-1-Chloro-1-butene	bute1cl1z
1690	C4H9F	1-fluorobutane	butaf1
1691	CH3CHFCH2CH3	2-fluorobutane	butaf2
1692	CH2ClCH2CH2CH3	Butane, 1-chloro-	butacl1
1693	CH3CCl(CH3)CH3	Propane, 2-chloro-2-methyl-	procl2me2
1694	CH3CHClCH2CH3	Butane, 2-chloro-	butacl2
1695	XeF4	Xenon tetrafluoride	xef4
1696	C2H2N2O	Furazan	furazan
1697	CF3PH2	phosphine, (trifluoromethyl)-	cf3ph2
1698	NH3BF3	Amminetrifluoroboron	nh3bf3
1699	C6H2	hexatriyne	c6h2
1700	C6H4	(E)-Hexa-1,5-diyne-3-ene	c6h4e
1701	C6H4	(Z)-Hexa-1,5-diyne-3-ene	c6h4z
1702	C6H4	Benzyne	benzyne
1703	C6H5	phenyl	phenyl
1704	C6H5-	phenyl anion	phenyl-
1705	C6H6	Prismane	prismane
1706	C6H6	1,2,4,5-Hexatetraene	ht1245
1707	C6H6	2,4-Hexadiyne	hexadiyne
1708	C6H6	3,4-Dimethylenecyclobutene	cb34m
1709	C6H6	Benzene	benzene
1710	C6H6	Benzvalene	bv
1711	C6H6	Dewar Benzene	dewar
1712	C6H6	Hexa-1,5-diene-3-yne	hdy153
1713	C6H6	Trimethylenecycopropane	tmcp
1714	C6H6+	Benzene cation	c6h6+
1715	C6H7+	benzene, protonated	c6h7+
1716	C6H8	(E)-hexa-1,3,5-triene	c821078
1717	C6H8	(E)-hexa-2,3,4-triene	c59660650
1718	C6H8	(Z)-hexa-1,3,5-triene	hexatri135
1719	C6H8	(Z)-hexa-2,3,4-triene	hetr234c
1720	C6H8	1,3-Cyclohexadiene	cyhexadiene13
1721	C6H8	1,4-Cyclohexadiene	cyhexadiene14
1722	C6H8	3-Methylenecyclopentene	c930267
1723	C6H8	Bicyclo[2.1.1]hex-2-ene	c822413
1724	C6H8	Bicyclo[2.2.0]hex-1(4)-ene	c30830207
1725	C6H8	Bicyclo[3.1.0]hex-2-ene	c694019
1726	C6H10	1,3-Hexadiene, (E)-	hexdi13e
1727	C6H10	1,3-Hexadiene, (Z)-	hexdi13z
1728	C6H10	1,4-Hexadiene, (E)-	hexdi14t
1729	C6H10	1,4-Hexadiene, (Z)-	hexdi14z
1730	C6H10	1,5-Hexadiene	c592427
1731	C6H10	1-Butyne, 3,3-dimethyl-	c917920
1732	C6H10	1-Hexyne	hexyne1
1733	C6H10	2,4-Hexadiene, (E,E)-	hexdi24ee
1734	C6H10	2,4-Hexadiene, (E,Z)-	hexdi24ez
1735	C6H10	2,4-Hexadiene, (Z,Z)-	hexdi24zz
1736	C6H10	2-Hexyne	c764352
1737	C6H10	3-Hexyne	hexyne3
1738	C6H10	cyclohexene	cyclohexene
1739	C6H10	Cyclopentene, 1-methyl-	c693890
1740	C6H10	Cyclopentene, 3-methyl-	c1120623
1741	C6H10	Cyclopentene, 4-methyl-	c1759815
1742	C4H6(CH3)2	1,1-dimethylcyclobutane	dmcb11
1743	C6H12	(1R,2R)-1,2-dimethylcyclobutane	dmcb12t
1744	C6H12	(1r,3r)-1,3-dimethylcyclobutane	dmcb13t
1745	C6H12	(E)-2-Hexene	e2hexene
1746	C6H12	(E)-3-methylpent-2-ene	c616126
1747	C6H12	(E)-hex-3-ene	e3hexene
1748	C6H12	(Z)-3-methylpent-2-ene	c922623
1749	C6H12	(Z)-hex-2-ene	z2hexene
1750	C6H12	(Z)-hex-3-ene	z3hexene
1751	C6H12	2,3-dimethylbut-1-ene	c563780
1752	C6H12	2,3-dimethyl-but-2-ene	tmeet
1753	C6H12	3-methylenepentane	c760214
1754	C6H12	cis-1,2-dimethylcyclobutane	dmcb12c
1755	C6H12	cis-1,3-dimethylcyclobutane	dmcb13c
1756	C6H12	Cyclohexane	cyclohexane
1757	C6H12	Cyclopentane, methyl-	c96377
1758	C6H12	Ethylcyclobutane	c4806615
1759	C6H12	hex-1-ene	hexene1
1760	C6H14	Butane, 2,2-dimethyl-	buta22
1761	C6H14	Butane, 2,3-dimethyl-	buta23
1762	C6H14	Hexane	hexane
1763	C6H14	Pentane, 2-methyl-	penta2
1764	C6H14	Pentane, 3-methyl-	penta3
1765	C4N2	2-Butynedinitrile	c4n2
1766	N3P3	1,3,5,2,4,6-Triazatriphosphorine	n3p3
1767	C4H2N2	Fumaronitrile	c4h2n2
1768	C2H2N4	sym-tetrazine	ttz
1769	C3H3N3	1,3,5-Triazine	triazine135
1770	CH3N5	5-Aminotetrazole	c4418615
1771	C4H4N2	1,3-Diazine	diazine13
1772	C4H4N2	Pyrazine	pyrazine
1773	C4H4N2	Pyridazine	pyridazine
1774	C4H4N2	Succinonitrile	c110612
1775	C2H4N4	1H-Tetrazole, 1-methyl-	c16681779
1776	C2H4N4	1H-Tetrazole, 5-methyl-	c4076362
1777	C2H4N4	2H-Tetrazole, 2-methyl-	c16681780
1778	C5H5N	Bicyclo[1.1.0]butane-1-carbonitrile	bibucn
1779	C5H5N	E-2,4-pentadienenitrile	bdcn
1780	C5H5N	Pyridine	pyridine
1781	B3N3H6	borazine	borazine
1782	C6H6	Fulvene	fulvene
1783	C5H6N+	Pyridinium	c5h6n
1784	C4H6N2	1H-Imidazole, 2-methyl-	c693981
1785	C5H7N	(E)-2-Pentenenitrile	c26294984
1786	C5H7N	(E)-3-Pentenenitrile	c16529661
1787	C5H7N	(Z)-2-Pentenenitrile	c25899507
1788	C5H7N	1H-Pyrrole, 1-methyl-	c96548
1789	C5H7N	Cyclobutanecarbonitrile	c4426113
1790	C5H9N	1,2,3,6-Tetrahydropyridine	c694053
1791	C5H9N	Butanenitrile, 2-methyl-	c18936179
1792	C5H9N	Pentanenitrile	c110598
1793	C5H9N	Propanenitrile, 2,2-dimethyl-	c630182
1794	C6H10	Bicyclo[3.1.0]hexane	c285585
1795	C5H11N	Cyclopentanamine	cypentam
1796	C5H11N	Piperidine	piper
1797	C4H12N2	1,2-Butanediamine	c4426486
1798	C4H12N2	2-Methyl-1,2-propanediamine	c811938
1799	Li2CO3	Lithium Carbonate	li2co3
1800	Na2CO3	Sodium Carbonate	na2co3
1801	C2O4--	oxalate anion	c2o4
1802	MgSO4	Magnesium Sulfate	mgso4
1803	N2O4	Dinitrogen tetroxide	n2o4
1804	C3H2O3	vinylene carbonate	vica
1805	C2H2O4	Oxalic Acid	oxalic
1806	C2H3NO3	Oxamic acid	oxamic
1807	C4H4O2	2(5H)-Furanone	furanone
1808	C4H4O2	2-Oxetanone, 4-methylene-	c674828
1809	C2H4N2O2	Oxalamide	oxalamide
1810	C2H4N2S2	Ethanedithioamide	c79403
1811	C2H4CO3	Ethylene carbonate	etco3
1812	C3H4O2S	2H-Thiete-1,1-dioxide	c7285327
1813	C3H4S3	1,3-Dithiolane-2-thione	c822388
1814	C2H4O4	Formic acid dimer	fadimer
1815	C4H5NO	3-Methylisoxazole	isox3m
1816	C4H5NO	Isoxazole, 5-methyl-	c5765446
1817	C4H5NS	4-Methylthiazole	c693958
1818	C2H5NO3	Nitric acid, ethyl ester	c625581
1819	C5H6O	2H-Pyran	pyran2
1820	C5H6O	2-methylfuran	furan2m
1821	C5H6O	3-Methylfuran	furan3m
1822	C5H6O	Pentadienal	pdal
1823	C5H6S	Thiophene, 2-methyl-	c554143
1824	C5H6S	Thiophene, 3-methyl-	c616444
1825	C4H6O2	γ–Butyrolactone	c96480
1826	C4H6O2	2,3-Butanedione	c431038
1827	C4H6O2	2-Propenoic acid, methyl ester	c96333
1828	C4H6O2	Crotonic Acid	crot
1829	C4H6OS	2,3-dihydrothiophene-2-ol	c9000117
1830	C4H6OS	2,5-dihydrothiophene-3-ol	c9000093
1831	C4H6OS	4,5-dihydrothiophene-2-ol	c9000106
1832	C4H6OS	4,5-dihydrothiophene-3-ol	c9000082
1833	C4H6OS	Dihydro-2-(3H)-thiophenone	c1003107
1834	C4H6OS	Dihydro-3-(2H)-thiophenone	c1003049
1835	C4H6OS	Vinyl sulfoxide	c1115157
1836	CH6N4S	Carbonothioic dihydrazide	thiacarb
1837	C2H6N2O2	(E)-Azodioxymethane	c37765154
1838	C2H6N2O2	Dimethylnitroamine	c4164287
1839	C3H6O3	1,3,5-Trioxane	trioxane
1840	C3H6S3	1,3,5-Trithiane	c3h6s3
1841	C3H6S3	Carbonotrithioic acid, dimethyl ester	c2314489
1842	C2H6O3S	Sulfurous acid, dimethyl ester	c616422
1843	C4H7NO	2-Pyrrolidinone	c616455
1844	C4H7NO	Ethoxyacetonitrile	etoaccn
1845	C4H7NO	Methacrylamide	c79390
1846	C4H7NO	Oxazole, 4,5-dihydro-2-methyl-	c1120645
1847	HCONH2CN2H4	formamide aminomethanimine dimer	d13
1848	C3H7ONO	Propyl nitrite	prono
1849	CH3CH(CH3)ONO	Isopropyl nitrite	c541424
1850	CH3CH(NH2)COOH	Alanine	alanine
1851	CH3NHCH2COOH	Sarcosine	sarcosine
1852	NH2CH2CH2COOH	β–alanine	betaalanine
1853	NH2COOC2H5	Urethane	urethane
1854	C5H8O	2H-Pyran, 3,4-dihydro-	c110872
1855	C5H8O	Cyclopentanone	c120923
1856	C5H8O	Furan, 2,3-dihydro-5-methyl-	c1487156
1857	C5H8O	Methyl cyclopropyl ketone	c765435
1858	N(CH3)2CONH2	Urea, N,N-dimethyl-	c598947
1859	NH(CH3)CONH(CH3)	Urea, N,N'-dimethyl-	c96311
1860	NH2CONHC2H5	Urea, ethyl-	c625525
1861	C4H8O2	1,3-Dioxane	dioxan13
1862	C4H8O2	1,3-Dioxolane, 2-methyl-	c497267
1863	C4H8O2	1,4-Dioxane	dioxan14
1864	C4H8O2	Ethene, 1,1-dimethoxy-	c922690
1865	C4H8O2	Ethyl acetate	c141786
1866	C4H8OS	s-Ethyl thioacetate	c625605
1867	C3H8O3	1,2,3-Propanetriol	glycerin
1868	C3H8O2S	(Methylsulfonyl)ethane	c594434
1869	C4H9NO	Butanamide	c541355
1870	C4H9NO	Propanamide, 2-methyl-	c563837
1871	C5H10O	2-Butanone, 3-methyl-	c563804
1872	C5H10O	2H-Pyran, tetrahydro-	c142687
1873	C5H10O	2-methylbutyraldehyde	2meba
1874	C5H10O	2-Pentanone	mpk
1875	C5H10O	3-Pentanone	dek
1876	C5H10O	Cyclopentanol	c96413
1877	C5H10O	Oxetane, 3,3-dimethyl-	c6921353
1878	C5H10O	Pentanal	pal
1879	C5H10S	2H-Thiopyran, tetrahydro-	c1613510
1880	C5H10S	3-Ethylthio-1-propene	c5296628
1881	C5H10S	Cyclopentanethiol	c1679078
1882	C5H10S	Thiophene, tetrahydro-2-methyl-	c1795091
1883	C5H10S	Thiophene, tetrahydro-3-methyl-	c4740005
1884	C4H10O2	1,1-Dimethoxyethane	c534156
1885	C4H10O2	1,3-Butanediol	budiol13
1886	C4H10O2	1,4-Butanediol	budiol14
1887	C4H10O2	Ethane, 1,2-dimethoxy-	c110714
1888	C4H10OS	Diethyl sulfoxide	c70291
1889	C4H10S2	1,4-Butanedithiol	budisl14
1890	C4H11NO	Diethylhydroxylamine	c3710847
1891	C5H12O	1-Butanol, 2-methyl-	c137326
1892	C5H12O	1-Butanol, 3-methyl-	c123513
1893	C5H12O	1-Pentanol	pentanol1
1894	C5H12O	2-Butanol, 3-methyl-	c598754
1895	C5H12O	2-Pentanol	peol2
1896	C5H12O	3-Pentanol	pentan3ol
1897	C5H12O	Butane, 1-methoxy-	meobu
1898	C5H12O	Propane, 1-ethoxy-	proet
1899	C5H12O	Propane, 2-methoxy-2-methyl-	c1634044
1900	C5H12S	1-Butanethiol, 2-methyl-	c1878188
1901	C5H12S	1-Butanethiol, 3-methyl-	c541311
1902	C5H12S	1-Pentanethiol	c110667
1903	C5H12S	1-Propanethiol, 2,2-dimethyl-	c1679089
1904	C5H12S	2-Butanethiol, 2-methyl-	c1679090
1905	C5H12S	2-Butanethiol, 3-methyl-	c2084186
1906	C5H12S	Butane, 1-(methylthio)-	c628295
1907	C5H12S	Ethyl propyl sulfide	c4110503
1908	C5H12S	Propane, 2-(ethylthio)-	c5145993
1909	C5H12S	Propane, 2-methyl-2-(methylthio)-	c6163640
1910	C4F2	difluorobutadiyne	c4f2
1911	ClCOClCO	Oxalyl chloride	oxcl
1912	CF3CN	Acetonitrile, trifluoro-	cf3cn
1913	CF3CN+	Acetonitrile, trifluoro- cation	cf3cn+
1914	B2F4	Diboron tetrafluoride	b2f4
1915	B2Cl4	Diboron tetrachloride	b2cl4
1916	C2F4	Tetrafluoroethylene	c2f4
1917	C2F4+	Tetrafluoroethylene cation	c2f4+
1918	C2ClF3	Ethene, chlorotrifluoro-	c2f3cl
1919	CF2CCl2	difluorodichloroethylene	cf2ccl2
1920	CFClCClF	trans-1,2-dichloro-1,2-difluoroethylene	cfclcclf
1921	CFClCFCl	cis-1,2-dichloro-1,2-difluoroethylene	cfclcfcl
1922	C2FCl3	fluorotrichloroethene	c2fcl3
1923	C2Cl4	Tetrachloroethylene	c2cl4
1924	C2Br4	tetrabromoethene	c2br4
1925	CF3OF	Trifluoromethylhypofluorite	cf3of
1926	SiF5-	silicon pentafluoride anion	sif5-
1927	SOF4	Sulfur tetrafluoride oxide	sof4
1928	PF5	Phosphorus pentafluoride	pf5
1929	AsF5	Arsenic pentafluoride	asf5
1930	PCl5	Phosphorus pentachloride	pcl5
1931	SF5	Sulfur pentafluoride	sf5
1932	SF5+	pentafluoro sulfur cation	sf5+
1933	SbCl5	Antimony pentachloride	sbcl5
1934	BrF5	bromine pentafluoride	brf5
1935	ClF5	chlorinepentafluoride	clf5
1936	IF5	pentafluoroiodine	if5
1937	CF3CHO	trifluoroacetaldehyde	cf3cho
1938	CCl3CHO	trichloroacetaldehyde	ccl3cho
1939	CHFClCHClF	ethane, 1,2-dichloro-1,2-difluoro-	chfclchclf
1940	CF3CH2F	1,1,1,2-tetrafluoroethane	cf3ch2f
1941	CHF2CHF2	1,1,2,2-tetrafluoroethane	chf2chf2
1942	CF3CH2Cl	2,2,2-Trifluoroethyl chloride	cf3ch2cl
1943	CHFClCHFCl	1,2-dichloro-1,2-difluoroethane RR	chfclchfcl
1944	CH2ClCCl3	1,1,1,2-tetrachloroethane	ch2clccl3
1945	CHCl2CHCl2	Ethane, 1,1,2,2-tetrachloro-	chcl2chcl2
1946	CH2BrCBr3	1,1,1,2-tetrabromo ethane	c2h2br4
1947	CHCl2CHF2	1,1-dichloro-2,2-difluoroethane	c2h2cl2f2
1948	CF3COOH	trifluoroacetic acid	cf3cooh
1949	C4H3ClO	Furan, 2-chloro	fur2cl
1950	C4H3ClO	Furan,3-chloro	fur3cl
1951	C3H5ClO2	Carbonochloridic acid, ethyl ester	c541413
1952	C3H5Cl3	Propane, 1,2,3-trichloro-	prcl135
1953	C4H8Cl2	1,4-Dichlorobutane	c110565
1954	C4H8Cl2	Butane, 1,2-dichloro-	c616217
1955	C4H8Cl2	Butane, 1,3-dichloro-	c1190223
1956	C4H8Cl2	Butane, 2,3-dichloro-, (r*,r*)-(.+/-.)-	c2211678
1957	C4H8Cl2	Butane, 2,3-dichloro-, (r*,s*)-	c4028562
1958	C4H9ClO	1-Chloro-2-ethoxyethane	c628342
1959	C5H11Cl	Pentane, 1-chloro-	pencl1
1960	C4H8O2	Butanoic acid	bua
1961	C6H5CH2	benzyl radical	benzyl
1962	C7H7	cycloheptatrienyl radical	c7h7
1963	C7H7+	cycloheptatrienyl cation	c7h7+
1964	C6H5CH3	toluene	toluene
1965	C7H8	cycloheptatriene	cht
1966	C7H8	Norbornadiene	norbor
1967	C7H8	Quadricyclane	qucy
1968	C7H12	Norbornane	nor
1969	C7H14	cycloheptane	c7h14
1970	C7H16	2-methylhexane	2mhex
1971	C7H16	3-methylhexane	hex3m
1972	C7H16	heptane	heptane
1973	CH(CN)3	tricyanomethane	mecn3
1974	HN=C=C(CN)2	Dicyanoketenimine	c4hn3
1975	C6H7N	2-Methylpyridine	mp
1976	C6H5NH2	aniline	aniline
1977	C6H13N	2-Methylpiperidine	pip2m
1978	C6H13N	cyclohexanamine	cham
1979	C6H15N	triethylamine	tea
1980	N2O5	Dinitrogen pentoxide	n2o5
1981	C4H2O3	Maleic Anhydride	malan
1982	C5H4O2	4-Cyclopentene-1,3-dione	cpdio
1983	C5H4O2	furfural	furfural
1984	C6H5O	phenoxy radical	phenoxy
1985	C5H5NO	2(1H)-Pyridinone	c72762006
1986	C5H5NO	2(3H)-Pyridinone	c9000048
1987	C5H5NO	2(5H)-Pyridinone	c9000037
1988	C5H5NO	2-Pyridinol	c109104
1989	C5H5NO	3(2H)-Pyridinone	c9000004
1990	C5H5NO	3(4H)-Pyridinone	c9000026
1991	C5H5NO	3(6H)-Pyridinone	c9000015
1992	C5H5NO	3-Pyridinol	c109002
1993	C5H5NO	4(1H)-Pryidinone	c9000060
1994	C5H5NO	4(3H)-Pryidinone	c9000059
1995	C5H5NO	4-Pyridinol	c626642
1996	C6H5OH	phenol	phenol
1997	C6H6O	2,4-Cyclohexadienone	c24599573
1998	C6H6O	2,5-Cyclohexadienone	c5664335
1999	C6H5SH	Benzenethiol	phsh
2000	HO2CCHNH2CH2OH	Serine	serine
2001	C5H8O2	Acetylacetone	acac
2002	C4H8O2S	Sulfolane	sulfolane
2003	C7H10	Norbornene	norbornene
2004	CH(C2H3)3	trivinyl methane	tvm
2005	C6H10O	cyclohexanone	chexo
2006	C6H12O	hexanal	c6h12o
2007	C6H12O	Oxepane	oxepane
2008	C3H7OC3H7	di-n-propyl ether	propr
2009	F2CCCF2	tetrafluoroallene	pfa
2010	CF3COO-	trifluoro acetate anion	cf3coo-
2011	CF3COF	trifluoroacetyl fluoride	cf3cof
2012	CF3COCl	trifluoroacetyl chloride	cf3cocl
2013	PF6	Hexafluorophosphate neutral	pf6
2014	PF6-	Hexafluorophosphate ion	pf6-
2015	SF6	Sulfur Hexafluoride	sf6
2016	SeF6	Selenium hexafluoride	sef6
2017	SF5Cl	sulfur chloropentafluoride	sf5cl
2018	CF3CHF2	pentafluoroethane	cf3chf2
2019	CF3CHFCl	1,1,1,2-tetrafluorochloroethane	cf3chfcl
2020	CF3CHCl2	1,1-Dichloro-2,2,2-trifluoroethane	cf3chcl2
2021	CHCl2CClF2	Ethane, 1,2,2-trichloro-1,1-difluoro-	chcl2cclf2
2022	CCl3CHCl2	pentachloroethane	ccl3chcl2
2023	C6H5F	Fluorobenzene	bzf
2024	C6H5Cl	chlorobenzene	bzcl
2025	C6H5Br	bromobenzene	bzbr
2026	C8H6	Calicene	calicene
2027	C6H5CCH	phenylacetylene	phac
2028	C8H6	benzocyclobutadiene	bcbd
2029	C8H6	Pentalene	pentalene
2030	C6H5CHCH2	Styrene	styrene
2031	C8H8	cubane	cubane
2032	C8H8	cyclooctatetraene	cot
2033	C6H5CH2CH3	Ethylbenzene	etbz
2034	CH3C6H4CH3	meta-xylene	mxylene
2035	CH3C6H4CH3	paraxylene	pxylene
2036	C8H14	Bicyclo[2.2.2]octane	bico222
2037	C8H16	cyclooctane	cyclooct
2038	(CH3)3CC(CH3)3	tetramethylbutane	tmb
2039	C8H18	Octane	c8h18
2040	C6H5CN	phenyl cyanide	phcn
2041	C6H12N2	Triethylenediamine	ted
2042	C4O4--	squarate dianion	c4o4--
2043	S4N4	Tetrasulfur tetranitride	s4n4
2044	S8	Octasulfur	s8
2045	C6H4O2	parabenzoquinone	pbq
2046	C4H4N2O2	Uracil	uracil
2047	C6H5CHO	benzaldehyde	benzal
2048	C6H5OCH3	Anisole	anisole
2049	C5H9NO2	Proline	proline
2050	C6H12O2	Methyl pivalate	c598981
2051	C6H12O2	Hexanoic acid	hexa
2052	C4F4	tetrafluorcyclobutadiene	c4f4
2053	Al2Cl6	Aluminum, di-μ-chlorotetrachlorodi-	al2cl6
2054	CF3CF2Cl	pentafluorochloroethane	cf3cf2cl
2055	CF2ClCF2Cl	1,2-Dichloro-1,1,2,2-tetrafluoroethane	cf2clcf2cl
2056	CF3CFCl2	1,1-Dichlorotetrafluoroethane	cf3cfcl2
2057	CF2ClCFCl2	Ethane, 1,1,2-trichloro-1,2,2-trifluoro-	cf2clcfcl2
2058	CF3CCl3	1,1,1-trifluoro-2,2,2-trichloroethane	cf3ccl3
2059	C2F6	hexafluoroethane	c2f6
2060	C2Cl6	hexachloroethane	c2cl6
2061	IF7	Iodine heptafluoride	if7
2062	C6H4F2	metadifluorobenzene	mdfb
2063	C6H4F2	orthodifluorobenzene	odfb
2064	C6H4F2	1,4-difluorobenzene	pdfb
2065	C6H4Cl2	1,2-dichlorobenzene	dcb12
2066	C6H4Cl2	1,3-dichlorobenzene	dcb13
2067	C6H4Cl2	1,4-dichlorobenzene	dcb14
2068	C6H5NO	nitrosobenzene	bzno
2069	C9H8	Indene	indene
2070	C9H8	spiro[4.4]nona-1,3,6,8-tetraene	snt
2071	C9H12	n-propyl benzene	prbz
2072	C9H20	Nonane	nonane
2073	C(CN)4	tetracyanomethane	c5n4
2074	C5H4N4	purine	purine
2075	C8H7N	Indole	indole
2076	C3H3N3O3	cyanuric acid	cyanuric
2077	C6H5NO2	Nitrobenzene	c6h5no2
2078	C6H5COOH	benzoic acid	benzo
2079	CH3COC6H5	acetophenone	acph
2080	C3Cl3N3	1,3,5-Triazine, 2,4,6-trichloro-	c3cl3n3
2081	C3F6	hexafluoropropene	c3f6
2082	C6H3F3	Benzene trifluoride 123	bzf3a
2083	C8H18O	1-Octanol	octanol
2084	C10H8	Azulene	azu
2085	C10H8	naphthalene	naph
2086	C10H10	bullvalene	bullv
2087	C10H16	adamantane	adamantane
2088	C6N4	Tetracyanoethylene	tcne
2089	C6N4-	tetracyanoethylene anion	tcne-
2090	C10H22	Decane	decane
2091	C4F6	perfluorobutadiene	c4f6
2092	SF5CF3	Sulfur, pentafluoro(trifluoromethyl)-	sf5cf3
2093	C3F8	perfluoropropane	c3f8
2094	Fe(CO)5	Iron pentacarbonyl	ipc
2095	Fe(C5H5)2	ferrocene	fecp2
2096	B12H12--	Dodecahydrododecaborate(2-)	b12h12--
2097	B12H12--	Dodecahydrododecaborate(2-)	b12h12--
2098	C12H8	Acenaphthylene	acenaph
2099	C12H8	biphenylene	biph
2100	C12H10	biphenyl	biphenyl
2101	C12H10	Heptalene	heptalene
2102	C6H12O6	Inositol	inositol
2103	C6F6	hexafluorobenzene	c6f6
2104	S2F10	disulphur decafluoride	s2f10
2105	C13H10	Fluorene	fluorene
2106	C14H10	Anthracene	anth
2107	C14H10	Phenanthrene	phenanthrene
2108	C14H14	Bibenzyl	bibenzyl
2109	C12H10N2	azobenzene	azobenzene
2110	C6H5COC6H5	benzophenone	benzophenone
2111	C16H10	Pyrene	pyrene
2112	C18H12	Tetracene	tetracene
2113	C19H16	Triphenylmethane	tpm
2114	C24H12	Coronene	coronene
2115	C60	Buckminsterfullerene	c60