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.)

List of which calculations are completed at QCISD(T) /6-311G**

Jump to calculations not yet done

count	Species	Name	State	Conformation
1	H2	Hydrogen diatomic	1Σg	D∞h
2	He	Helium atom	1S	Kh
3	Li	Lithium atom	2S	Kh
4	Na	Sodium atom	2S	Kh
5	K	Potassium atom	2S	Kh
6	Cu	Copper atom	2S	Kh
7	LiH	Lithium Hydride	1Σ	C∞v
8	CuH	Copper monohydride	1Σ	C∞v
9	Be	Beryllium atom	1S	Kh
10	Be+	Beryllium atom cation	2S	Kh
11	Mg	Magnesium atom	1S	Kh
12	Mg+	Magnesium atom cation	2S	Kh
13	Ca	Calcium atom	1S	Kh
14	Zn	Zinc atom	1S	Kh
15	CaH	Calcium monohydride	2Σ	C∞v
16	B	Boron atom	2P	Kh
17	B	Boron atom	4P	Kh
18	B+	Boron atom cation	1S	Kh
19	Al	Aluminum atom	2P	Kh
20	Al+	Aluminum atom cation	1S	Kh
21	C	Carbon atom	3P0	Kh
22	C	Carbon atom	3P1	Kh
23	C+	Carbon atom cation	2P	Kh
24	Si	Silicon atom	3P	Kh
25	Si	Silicon atom	1S	Kh
26	Si+	Silicon atom cation	2P	Kh
27	CH4	Methane	1A1	Td
28	N	Nitrogen atom	4S	Kh
29	N	Nitrogen atom	2D	Kh
30	N+	Nitrogen atom cation	3P	Kh
31	P	Phosphorus atom	4S	Kh
32	NH3	Ammonia	1A1	C3v
33	O	Oxygen atom	3S	Kh
34	O+	Oxygen atom cation	4S	Kh
35	S	Sulfur atom	3P	Kh
36	OH	Hydroxyl radical	2Π	C∞v
37	H2O	Water	1A1	C2v
38	F	Fluorine atom	2P	Kh
39	F+	Fluorine atom cation	3S	Kh
40	Cl	Chlorine atom	2P	Kh
41	Cl+	Chlorine atom cation	3P	Kh
42	Br	Bromine atom	2P	Kh
43	HF	Hydrogen fluoride	1Σ	C∞v
44	HCl	Hydrogen chloride	1Σ	C∞v
45	HI	Hydrogen iodide	1Σ	C∞v
46	Ne	Neon atom	1S	Kh
47	Ne+	Neon atom cation	2P	Kh
48	Ar	Argon atom	1S	Kh
49	NaLi	lithium sodium	1Σ	C∞v
50	Na2	Sodium diatomic	1Σg	D∞h
51	C2H2	Acetylene	1Σg	D∞h
52	CCH2	vinylidene	1A1	C2v
53	CCH2	vinylidene	3B2	C2v
54	CuCH3	monomethyl copper	1A1	C3v
55	C2H4	Ethylene	1Ag	D2h
56	C2H6	Ethane	1A1g	D3d
57	BN	boron nitride	3Π	C∞v
58	AlN	Aluminum nitride	3Πi	C∞v
59	N2	Nitrogen diatomic	1Σg	D∞h
60	NNH	Dinitrogen monohydride	2A'	Cs
61	N2H2	(E)-diazene	1Ag	C2h
62	BO-	boron monoxide anion	1Σ	C∞v
63	CO	Carbon monoxide	1Σ	C∞v
64	NO	Nitric oxide	2Π	C∞v
65	O2	Oxygen diatomic	3Σg	D∞h
66	CaOH	Calcium monohydroxide	2Σ+	C∞v
67	HCS	Thioformyl radical	2A'	Cs
68	H2CO	Formaldehyde	1A1	C2v
69	CuF	Copper monofluoride	1Σ	C∞v
70	LiBr	Lithium Bromide	1Σ	C∞v
71	CuCl	Copper monochloride	1Σ	C∞v
72	NaBr	Sodium Bromide	1Σ	C∞v
73	CaF	Calcium monofluoride	2Σ	C∞v
74	CaCl	calcium monochloride	2Σ	C∞v
75	BF	Boron monofluoride	1Σ	C∞v
76	CF-	carbon monofluoride anion	3Σ	C∞v
77	F2	Fluorine diatomic	1Σg	D∞h
78	Cl2	Chlorine diatomic	1Σg	D∞h
79	HOBr	Hypobromous acid	1A'	Cs
80	CH3I	methyl iodide	1A1	C3v
81	C3H5	Allyl radical	2A2	C2v
82	C3H6	Cyclopropane	1A1'	D3h
83	CH2CHCH3	Propene	1A'	Cs
84	CH2NN	diazomethane	1A1	C2v
85	NH2CN	cyanamide	1A'	Cs
86	CH3NC	methyl isocyanide	1A1	C3v
87	CO2	Carbon dioxide	1Σg	D∞h
88	SO2	Sulfur dioxide	1A1	C2v
89	C2H2O	Oxirene	1A1	C2v
90	HCCOH	ethynol	1A'	Cs
91	CH2O2	Dioxirane	1A1	C2v
92	CH2CHOH	ethenol	1A'	Cs
93	CaF2	Calcium difluoride	1Σg	C2v
94	HFCO	formyl fluoride	1A'	Cs
95	CH2FI	fluoroiodomethane
96	CH2I2	Diiodomethane
97	C2H3Br	vinyl bromide	1A'	Cs
98	C2H5F	fluoroethane	1A'	Cs
99	CH2CHCHO	Acrolein	1A'	Cs
100	CHOCH2OH	hydroxy acetaldehyde	1A'	CS H in
101	C3H7OH	1-Propanol	1A'	Cs
102	C2F2	difluoroacetylene	1Σg	D∞h
103	BF3	Borane, trifluoro-	1A'	D3h
104	AlF3	Aluminum trifluoride	1A1'	D3h
105	CHF2I	difluoroiodomethane
106	CHFClI	fluorochloroiodomethane
107	C2H2F2	Ethene, 1,2-difluoro-, (E)-	1Ag	C2h
108	C2H2F2	Ethene, 1,2-difluoro-, (Z)-	1A1	C2v
109	N2O3	Dinitrogen trioxide	1A'	Cs
110	CaCO3	Calcium Carbonate	1A1	C2v
111	CH3SSSCH3	dimethyl trisulfide	1A	C2
112	C2HF3	Trifluoroethylene	1A'	Cs
113	HClO4	perchloric acid	1A	Cs

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