Species list
################################################################################
1:H;
2:H2;
4:He;
14:N;
15:CH3;
16:CH4\O;
17:H3N\HO;
18:H2O;
20:D3N\Ne;
25:C2H;
26:C2H2;
27:C2H3\CHN;
28:C2H4\CO\N2;
29:C2H5\CHO;
30:C2H6\CH2O\NO;
31:CH3O\CH5N;
32:CH4O\H4Si\O2;
33:HO2;
34:H2O2\H2S;
38:C3H2;
39:C3H3;
40:Ar\C3H4;
41:C2HO\C3H5;
42:C2H2O\C3H6;
43:C2H3O\C3H7;
44:C2H4O\C3H8\CO2\N2O;
45:C2H5O\C2H7N\CHO2;
46:C2H6O\CH2O2\NO2;
50:C4H2;
51:C4H3;
52:C4H4;
53:C4H5;
54:C3H2O\C4H6;
55:C3H3O\C4H7;
56:C3H4O\C4H8;
57:C3H5O\C4H9;
58:C3H6O\C4H10;
59:C3H7O\C3H9N;
60:C2H4O2\C3H8O;
61:CH3NO2;
62:C2H6O2\C5H2\H6Si2;
63:C5H3;
64:C5H4;
65:C5H5;
66:C5H6;
67:C4H5N\C5H7;
68:C4H4O\C5H8;
70:C4H6O\C5H10;
71:C4H9N;
72:C4H8O\C5H12;
73:C4H11N;
74:C3H6O2\C3H6O2\C4H10O\C6H2;
75:C2H5NO2;
76:C3H8O2\C6H4;
77:C6H5;
78:C6H6\H4Ge;
79:C5H5N\C6H7;
80:C5H4O\C6H8;
82:C5H6O\C6H10;
84:C5H8O\C6H12\Kr;
85:C5H11N;
86:C5H10O\C6H14;
87:C4H9NO;
88:C4H12Si\C4H8O2\C5H12O\C7H4;
89:C3H7NO2\C4H11NO\C7H5;
90:C7H6;
91:C7H7;
92:C7H8;
93:C6H7N;
94:C6H6O;
96:C2H2Cl2\C5H4O2\C6H8O;
98:C7H14\C8H2;
99:C6H13N;
100:C5H8O2\C7H16\C8H4;
101:C6H15N;
102:C5H10O2\C6H14O\C8H6;
103:C7H5N;
104:C8H8\F4Si;
105:C8H9;
106:C7H6O\C8H10;
107:C7H9N;
108:C6H4O2\C7H8O;
110:C6H6O2;
112:C6H5Cl\C9H4;
114:C8H18\C9H6;
115:C9H7;
116:C9H8;
117:C8H7N;
118:C9H10;
120:C8H8O\C9H12;
122:C10H2\C8H10O;
123:C6H5NO2;
126:C10H6\C7H7Cl;
128:C10H8\C9H20;
129:C10H9\C8H19N;
130:C10H10\C2HCl3\C9H6O;
131:C10H11;
132:C10H12\Xe;
134:C10H14;
138:C10H18;
139:C11H7;
140:C11H8;
142:C10H22\C11H10;
144:C10H8O\C11H12;
146:C11H14;
150:C12H6;
152:C12H8;
154:C12H10;
156:C11H24\C12H12;
165:C13H9;
166:C13H10\C2Cl4;
168:C13H12;
170:C12H10O\C12H26\SiCl4;
176:C14H8;
178:C14H10;
180:C14H12;
182:C14H14;
184:C13H28;
190:C15H10;
192:C15H12;
198:C14H30;
202:C16H10;
204:C16H12;
212:C15H32;
216:C17H12;
220:C6O6Cr;
226:C16H34\C18H10;
228:C18H12;
242:C19H14;
250:C20H10;
252:C20H12;
254:C20H14\C21H12;
266:C21H14\C6O6Mo;
300:C24H12;
352:C6O6W;
720:C60
################################################################################

File name
################################################################################
1-H-Atomic hydrogen-Palenius-1976
2-H2-Hydrogen-Backx-1976
2-H2-Hydrogen-Ford-1975
4-He-Helium-Bizau-1995
4-He-Helium-Marr-1976
4-He-Helium-Samson-1994
4-He-Helium-Samson-2002
4-He-Helium-West-1976
4-He-Helium-Yan-1998
14-N-Atomic nitrogen-Fennelly-1992
14-N-Atomic nitrogen-Samson-1990
15-CH3-Methyl radical-Gans-2010
15-CH3-Methyl radical-Loison-2010
15-CH3-Methyl radical-Savee-2012
15-CH3-Methyl radical-Taatjes-2008
16-CH4-Methane-Kameta-2002
16-CH4-Methane-Samson-1989
16-CH4-Methane-Wang-2008
16-O-Atomic oxygen-Angel-1988
16-O-Atomic oxygen-Fennelly-1992
16-O-Atomic oxygen-Samson-1985
17-H3N-Ammonia-Edvardsson-1999
17-H3N-Ammonia-Samson-1987
17-H3N-Ammonia-Walker-1955
17-H3N-Ammonia-Watanabe-1954
17-HO-Hydroxyl radical-Dehmer-1984
18-H2O-Water-Dehmer-1991
18-H2O-Water-Haddad-1986
18-H2O-Water-Katayama-1973
18-H2O-Water-Watanabe-1964
20-D3N-(2H3)Ammonia-Edvardsson-1999
20-Ne-Neon-Bizau-1995
20-Ne-Neon-Ederer-1964
20-Ne-Neon-Marr-1976
20-Ne-Neon-Samson-2002
20-Ne-Neon-West-1976
25-C2H-Ethynyl radical-Estimated
26-C2H2-Acetylene-Cool-2005
26-C2H2-Acetylene-Hatano-1999
26-C2H2-Acetylene-Hayaishi-1982
26-C2H2-Acetylene-Mackie-2003
26-C2H2-Acetylene-Person-1970
26-C2H2-Acetylene-Schoen-1962
26-C2H2-Acetylene-Walker-1955
27-C2H3-Vinyl radical-Robinson-2003
27-CHN-Hydrogen cyanide-Wirsich-1990
28-C2H4-Ethylene-Chen-1999
28-C2H4-Ethylene-Cool-2003
28-C2H4-Ethylene-Cool-2005
28-C2H4-Ethylene-Estimated
28-C2H4-Ethylene-Holland-1997
28-C2H4-Ethylene-Mackie-2003
28-C2H4-Ethylene-Person-1968
28-C2H4-Ethylene-Schoen-1962
28-C2H4-Ethylene-Walker-1955
28-CO-Carbon monoxide-El-Sherbini-1972
28-CO-Carbon monoxide-Samson-1976
28-CO-Carbon monoxide-Wight-1976
28-N2-Nitrogen-El-Sherbini-1972
28-N2-Nitrogen-Fennelly-1992
28-N2-Nitrogen-Wight-1976
29-C2H5-Ethyl radical-FitzPatrick-2007
29-C2H5-Ethyl radical-Gans-2011
29-C2H5-Ethyl radical-Li-Estimated-2007
29-C2H5-Ethyl radical-Ruscic-1989
29-C2H5-Ethyl radical-Wang-2006
29-CHO-Formyl radical-Estimated
29-CHO-Formyl radical-Shubert-2010
30-C2H6-Ethane-ALS-Unpublished
30-C2H6-Ethane-Au-1993
30-C2H6-Ethane-Kameta-1996
30-C2H6-Ethane-Kameta-2002
30-C2H6-Ethane-Schoen-1962
30-C2H6-Ethane-Wang-2008
30-CH2O-Formaldehyde-Cooper-1996
30-CH2O-Formaldehyde-Estimated
30-CH2O-Hydroxymethylene-Estimated
30-NO-Nitric oxide-Adam-2007
30-NO-Nitric oxide-Erman-1995
30-NO-Nitric oxide-Killgoar-1973
30-NO-Nitric oxide-Ono-1980
30-NO-Nitric oxide-Walker-1955
30-NO-Nitric oxide-Watanabe-1954
30-NO-Nitric oxide-Watanabe-1967
31-CH3O-Hydroxymethyl radical-Estimated
31-CH3O-Methoxy radical-Estimated
31-CH5N-Methylamine-Yang-2012
32-CH4O-Methanol-Cool-2005
32-CH4O-Methanol-Person-1971
32-CH4O-Methanol-Zhou-2009
32-H4Si-Silane-Kameta-1991
32-O2-Oxygen-Brion-1979
32-O2-Oxygen-Fennelly-1992
32-O2-Oxygen-Holland-1993
32-O2-Oxygen-Samson-1977
33-HO2-Hydroperoxy radical-Estimated
34-H2O2-Hydrogen peroxide-Li-Estimated-2011
34-H2S-Hydrogen sulfide-Watanabe-1964
38-C3H2-Cyclopropenylidene-Taatjes-2005
38-C3H2-Triplet propargylene-Hansen-2007
38-C3H2-Triplet propargylene-Li-Estimated-2007
38-C3H2-Triplet propargylene-Taatjes-2005
39-C3H3-Cyclopropenyl radical-Estimated
39-C3H3-Propargyl radical-Li-Estimated-2007
39-C3H3-Propargyl radical-Robinson-2003
39-C3H3-Propargyl radical-Savee-2012
39-C3H3-Propargyl radical-Yang-Estimated-2011
40-Ar-Argon-Chapman-1972
40-Ar-Argon-Marr-1976
40-Ar-Argon-Samson-2002
40-Ar-Argon-West-1976
40-Ar-Argon-Zheng-2006
40-C3H4-Allene-Cool-2003
40-C3H4-Allene-Holland-1999
40-C3H4-Allene-Yang-2012
40-C3H4-Cyclopropene-Estimated
40-C3H4-Propyne-Adam-2007
40-C3H4-Propyne-Cool-2003
40-C3H4-Propyne-Cool-2005
40-C3H4-Propyne-Ho-1998
40-C3H4-Propyne-Person-1970
41-C2HO-Ethynyloxy radical-Estimated
41-C3H5-2-Propenyl-Robinson-2004
41-C3H5-Allyl radical-Robinson-2004
41-C3H5-Cyclopropyl radical-Estimated
42-C2H2O-Ketene-Li-Estimated-2007
42-C2H2O-Ketene-Yang-2012
42-C3H6-Cyclopropane-Estimated
42-C3H6-Cyclopropane-Kameta-1999
42-C3H6-Cyclopropane-Koizumi-1991
42-C3H6-Cyclopropane-Schoen-1962
42-C3H6-Cyclopropane-Wang-2008
42-C3H6-Propene-Adam-2007
42-C3H6-Propene-Cool-2003
42-C3H6-Propene-Kanno-2007
42-C3H6-Propene-Koizumi-1991
42-C3H6-Propene-Person-1970
42-C3H6-Propene-Schoen-1962
43-C2H3O-Acetyl radical-Estimated
43-C2H3O-Vinyloxy radical-Estimated
43-C3H7-Isopropyl radical-Estimated
43-C3H7-n-Propyl radical-Estimated
44-C2H4O-Acetaldehyde-Adam-2007
44-C2H4O-Acetaldehyde-Cool-2003
44-C2H4O-Acetaldehyde-Kanno-2007
44-C2H4O-Ethenol-Cool-2003
44-C2H4O-Ethylene oxide-Estimated
44-C3H8-Propane-Au-1993
44-C3H8-Propane-Cool-2005
44-C3H8-Propane-Kameta-2002
44-C3H8-Propane-Schoen-1962
44-CO2-Carbon dioxide-Hitchcock-1980
44-CO2-Carbon dioxide-Masuoka-1994
44-CO2-Carbon dioxide-Shaw-1995
44-N2O-Nitrous oxide-Hitchcock-1980
44-N2O-Nitrous oxide-Shaw-1992
44-N2O-Nitrous oxide-Walker-1955
45-C2H5O-1-Hydroxyethyl radical-Estimated
45-C2H5O-2-Hydroxyethyl radical-Estimated
45-C2H5O-Ethoxy radical-Yang-Estimated-2011
45-C2H5O-Methoxymethyl radical-Yang-Estimated-2011
45-C2H7N-Ethylamine-Yang-2012
45-CHO2-Hydrocarboxyl radical-Estimated
46-C2H6O-Dimethyl ether-Cool-2005
46-C2H6O-Dimethyl ether-Kameta-1992
46-C2H6O-Dimethyl ether-Kanno-2007
46-C2H6O-Dimethyl ether-Koizumi-1991
46-C2H6O-Ethanol-Cool-2005
46-C2H6O-Ethanol-Koizumi-1986
46-C2H6O-Ethanol-Person-1971
46-CH2O2-Formic acid-Cool-2005
46-NO2-Nitrogen dioxide-Au-1997
50-C4H2-Diacetylene-Cool-2005
50-C4H2-Diacetylene-Li-Estimated-2007
51-C4H3-iC4H3 radical-Hansen-2007
51-C4H3-iC4H3 radical-Li-Estimated-2007
52-C4H4-1,2,3-Butatriene-Li-Estimated-2007
52-C4H4-Cyclobutadiene-Li-Estimated-2007
52-C4H4-Vinylacetylene-Cool-2005
53-C4H5-1,3-Butadien-2-yl radical-Li-Estimated-2007
53-C4H5-But-1-yn-3-yl radical-Li-Estimated-2007
53-C4H5-But-2-yn-1-yl radical-Li-Estimated-2007
54-C3H2O-2-Cyclopropen-1-one-Estimated
54-C3H2O-2-Propynal-Estimated
54-C3H2O-Propadienal-Estimated
54-C4H6-1,2-Butadiene-Estimated
54-C4H6-1,3-Butadiene-Adam-2007
54-C4H6-1,3-Butadiene-Cool-2005
54-C4H6-1,3-Butadiene-Kanno-2007
54-C4H6-1,3-Butadiene-Schoen-1962
54-C4H6-1,3-Butadiene-Yang-2012
54-C4H6-1-Butyne-Adam-2007
54-C4H6-1-Butyne-Wang-2008
54-C4H6-2-Butyne-ALS-Unpublished
54-C4H6-2-Butyne-Wang-2008
54-C4H6-Cyclobutene-Estimated
55-C3H3O-Propenoyl radical-Estimated
55-C4H7-1-Buten-3-yl radical-Estimated
55-C4H7-2-Methylallyl radical-Estimated
55-C4H7-But-3-en-1-yl radical-Estimated
55-C4H7-Cyclobutyl radical-Estimated
56-C3H4O-2-Propenal-Adam-2007
56-C3H4O-2-Propenal-Estimated
56-C3H4O-2-Propenal-Yang-Estimated-2011
56-C3H4O-Cyclopropanone-Estimated
56-C3H4O-Methoxyacetylene-Estimated
56-C3H4O-Methylketene-Li-Estimated-2011
56-C3H4O-Propargyl alcohol-Estimated
56-C4H8-1-Butene-Adam-2007
56-C4H8-1-Butene-Koizumi-1991
56-C4H8-1-Butene-Wang-2008
56-C4H8-cis-2-Butene-Koizumi-1991
56-C4H8-cis-2-Butene-Schoen-1962
56-C4H8-cis-2-Butene-Wang-2008
56-C4H8-Cyclobutane-Estimated
56-C4H8-Isobutene-Koizumi-1991
56-C4H8-Isobutene-Wang-2008
56-C4H8-trans-2-Butene-Koizumi-1991
56-C4H8-trans-2-Butene-Yang-2012
57-C3H5O-Propionyl radical-Estimated
57-C4H9-1-Butyl radical-Estimated
57-C4H9-2-Butyl radical-Estimated
57-C4H9-Isobutyl radical-Estimated
57-C4H9-Tertbutyl radical-Estimated
58-C3H6O-2-Propen-1-ol-Yang-2012
58-C3H6O-Acetone-Adam-2007
58-C3H6O-Acetone-Cool-2005
58-C3H6O-Acetone-Kanno-2007
58-C3H6O-Acetone-Zhou-2009
58-C3H6O-Cyclopropanol-Estimated
58-C3H6O-Methyl vinyl ether-Estimated
58-C3H6O-Propanal-Kanno-2007
58-C3H6O-Propanal-Wang-2008
58-C3H6O-Propen-2-ol-Li-Estimated-2011
58-C3H6O-Propylene oxide-Estimated
58-C4H10-Isobutane-Yang-2012
58-C4H10-n-Butane-Au-1993
58-C4H10-n-Butane-Kanno-2007
58-C4H10-n-Butane-Person-1968
58-C4H10-n-Butane-Schoen-1962
58-C4H10-n-butane-Wang-2008
59-C3H7O-1-Methoxyethyl radical-Estimated
59-C3H7O-1-Methylethoxy radical-Estimated
59-C3H7O-CH2CH2CH2OH radical-Estimated
59-C3H7O-n-Propoxy radical-Estimated
59-C3H9N-Isopropylamine-Xie-2011
59-C3H9N-n-Propylamine-Xie-2011
60-C2H4O2-Acetic acid-Estimated
60-C2H4O2-Formaldehyde dimer-Estimated
60-C2H4O2-Methyl formate-Wang-2010
60-C3H8O-1-Propanol-Cool-2005
60-C3H8O-1-Propanol-Koizumi-1991
60-C3H8O-2-Propanol-Cool-2005
60-C3H8O-2-Propanol-Koizumi-1991
60-C3H8O-Ethyl methyl ether-Kameta-1992
60-C3H8O-Ethyl methyl ether-Koizumi-1991
61-CH3NO2-Nitromethane-Xie-2011
62-C2H6O2-1,2-Ethanediol-Estimated
62-C5H2-1,3-Pentadiynylide radical-Yang-Estimated-2011
62-H6Si2-Disilane-Kameta-1991
63-C5H3-HCCCCCH2 radical-Hansen-2006
63-C5H3-HCCCCCH2 radical-Li-Estimated-2011
63-C5H3-HCCCHCCH radical-Hansen-2006
63-C5H3-HCCCHCCH radical-Li-Estimated-2007
64-C5H4-1,2,3,4-Pentatetraene-Li-Estimated-2007
64-C5H4-1,3-Pentadiyne-Goulay-2007
64-C5H4-1,3-Pentadiyne-Hansen-2006
64-C5H4-1,3-Pentadiyne-Li-Estimated-2007
64-C5H4-1,3-Pentadiyne-Yang-Estimated-2011
64-C5H4-1,4-Pentadiyne-Goulay-2007
64-C5H4-Ethynylallene-Cheng-Estimated-2011
64-C5H4-Ethynylallene-Goulay-2007
64-C5H4-Ethynylallene-Hansen-2006
65-C5H5-Cyclopentadienyl radical-Hansen-2006
65-C5H5-Cyclopentadienyl radical-Li-Estimated-2007
65-C5H5-Pent-1-en-4-yn-3-yl radical-Li-Estimated-2007
66-C5H6-1,2,4-Pentatriene-Estimated
66-C5H6-1,3-Cyclopentadiene-Hansen-2006
66-C5H6-1,3-Cyclopentadiene-Li-Estimated-2011
66-C5H6-1,3-Cyclopentadiene-Taatjes-2010
66-C5H6-1-Penten-3-yne-Hansen-2006
66-C5H6-1-Penten-4-yne-Hansen-2006
66-C5H6-3-Penten-1-yne-Hansen-2006
67-C4H5N-Pyrrole-Xie-2011
67-C5H7-1,4-Pentadien-3-yl radical-Estimated
68-C4H4O-Furan-Xie-2010
68-C4H4O-Furan-Yang-2012
68-C5H8-1,3-Pentadiene-Yang-2012
68-C5H8-1,4-Pentadiene-Yang-2012
68-C5H8-2-Methyl-1,3-butadiene-Adam-2007
68-C5H8-2-Methyl-1,3-butadiene-Kanno-2007
68-C5H8-3-Methyl-1,2-butadiene-Yang-2012
68-C5H8-Cyclopentene-Cool-2005
70-C4H6O-2,3-Dihydrofuran-Yang-2012
70-C4H6O-2,5-Dihydrofuran-Yang-2012
70-C4H6O-2-Butenal-Yang-2012
70-C4H6O-Methyl vinyl ketone-Yang-2012
70-C5H10-1-Pentene-Adam-2007
70-C5H10-1-Pentene-Wang-2008
70-C5H10-2-Methyl-1-butene-Yang-2012
70-C5H10-2-Methyl-2-butene-Yang-2012
70-C5H10-3-Methyl-1-butene-Yang-2012
70-C5H10-cis-2-Pentene-Cool-2005
70-C5H10-Cyclopentane-Zhou-2010
70-C5H10-trans-2-Pentene-Cool-2005
71-C4H9N-Pyrrolidine-Xie-2011
72-C4H8O-Isobutanal-Yang-2012
72-C4H8O-n-Butanal-Yang-2012
72-C4H8O-Tetrahydrofuran-Kanno-2007
72-C4H8O-Tetrahydrofuran-Wang-2008
72-C5H12-n-Pentane-Adam-2007
72-C5H12-n-Pentane-Schoen-1962
72-C5H12-n-Pentane-Zhou-2010
73-C4H11N-1-Butylamine-Xie-2011
73-C4H11N-2-Butylamine-Xie-2011
73-C4H11N-Diethylamine-Xie-2011
73-C4H11N-Isobutylamine-Xie-2011
73-C4H11N-Tertbutylamine-Xie-2011
74-C3H6O2-Ethyl formate-Wang-2010
74-C3H6O2-Methyl acetate-Wang-2008
74-C4H10O-1-Butanol-Xie-2010
74-C4H10O-2-Butanol-Xie-2010
74-C4H10O-Diethyl ether-Cool-2005
74-C4H10O-Isobutanol-Xie-2010
74-C4H10O-tert-Butanol-Xie-2010
74-C6H2-1,3,5-Hexatriyne-Hansen-2007
74-C6H2-1,3,5-Hexatriyne-Li-Estimated-2007
74-C6H2-1,3,5-Hexatriyne-Yang-Estimated-2011
75-C2H5NO2-Nitroethane-Xie-2011
76-C3H8O2-Dimethoxymethane-Yang-2012
76-C6H4-Benzyne-Hansen-2007
76-C6H4-Benzyne-Li-Estimated-2007
76-C6H4-Benzyne-Yang-Estimated-2011
76-C6H4-Hex-3-ene-1,5-diyne-Li-Estimated-2007
76-C6H4-Hex-3-ene-1,5-diyne-Yang-Estimated-2011
77-C6H5-Phenyl radical-Li-Estimated-2007
78-C6H6-1,3-Hexadiyne-Soorkia-2010
78-C6H6-2-Ethynyl-1,3-butadiene-Soorkia-2010
78-C6H6-3,4-Dimethylenecyclobut-1-ene-Soorkia-2010
78-C6H6-3,4-Hexadiene-1-yne-Soorkia-2010
78-C6H6-Benzene-Adam-2007
78-C6H6-Benzene-Cool-2005
78-C6H6-Benzene-Kanno-2007
78-C6H6-Benzene-Person-1965
78-C6H6-Benzene-Rennie-1998
78-C6H6-Benzene-Yoshino-1973
78-C6H6-Fulvene-Hansen-2007
78-C6H6-Fulvene-Li-Estimated-2007
78-C6H6-Fulvene-Soorkia-2010
78-H4Ge-Germanium tetrahydride-Wu-1993
79-C5H5N-Pyridine-Xie-2011
79-C6H7-Cyclohexa-2,5-dienylium-Estimated
80-C5H4O-2,4-Cyclopentadiene-1-one-Yang-Estimated-2011
80-C6H8-1,3-Cyclohexadiene-Wang-2008
80-C6H8-1,4-Cyclohexadiene-Kanno-2007
80-C6H8-1,4-Cyclohexadiene-Yang-Estimated-2011
82-C5H6O-2-Cyclopenten-1-one-Yang-Estimated-2011
82-C5H6O-2-Methylfuran-Xie-2010
82-C6H10-1,3-Hexadiene-Wang-2008
82-C6H10-1,5-Hexadiene-Yang-2012
82-C6H10-2,4-Hexadiene-Yang-Estimated-2011
82-C6H10-Cyclohexene-Wang-2008
84-C5H8O-3-Methyl-2-butenal-Yang-2012
84-C6H12-1-Hexene-Koizumi-1991
84-C6H12-1-Hexene-Yang-2012
84-C6H12-2,3-Dimethyl-2-butene-Koizumi-1991
84-C6H12-3,3-Dimethyl-1-butene-Wang-2008
84-C6H12-Cyclohexane-Cool-2005
84-C6H12-Cyclohexane-Kanno-2007
84-C6H12-Cyclohexane-Koizumi-1991
84-C6H12-Cyclohexane-Zhou-2009
84-C6H12-Methylcyclopentane-Wang-2008
84-C6H12-trans-2-Hexene-Yang-2012
84-Kr-Krypton-Marr-1976
84-Kr-Krypton-Samson-2002
84-Kr-Krypton-West-1976
85-C5H11N-Piperidine-Yang-2012
86-C5H10O-2-Methyltetrahydrofuran-Yang-2012
86-C5H10O-Methyl Propenoate-Wang-2010
86-C5H10O-Tetrahydropyran-Yang-2012
86-C5H10O-Vinyl acetate-Wang-2010
86-C6H14-n-Hexane-Adam-2007
86-C6H14-n-Hexane-Zhou-2010
87-C4H9NO-Morpholine-Xie-2011
88-C4H12Si-Tetramethylsilane-Kameta-1993
88-C4H8O2-Ethyl acetate-Wang-2008
88-C4H8O2-Methyl propionate-Wang-2010
88-C5H12O-1-Pentanol-Xie-2010
88-C5H12O-Isopentanol-Xie-2010
88-C5H12O-Methyl tert-butyl ether-Xie-2010
88-C5H12O-tert-Pentanol-Xie-2010
88-C7H4-1,3,5-Heptatriyne-Li-Estimated-2007
89-C3H7NO2-1-Nitropropane-Xie-2011
89-C4H11NO-N,N-Dimethylaminoethanol-Xie-2011
89-C7H5-1-Ethynylcyclopenta-2,4-dienide-Li-Estimated-2011
89-C7H5-1-Ethynylcyclopenta-2,4-dienide-Yang-Estimated-2011
90-C7H6-5-Ethenylidene-1,3-cyclopentadiene-Li-Estimated-2007
91-C7H7-Benzyl radical-Li-Estimated-2011
92-C7H8-5-Methylene-1,3-cyclohexadiene-Li-Estimated-2007
92-C7H8-Toluene-Adam-2007
92-C7H8-Toluene-Kanno-2007
92-C7H8-Toluene-Zhou-2009
93-C6H7N-Aniline-Xie-2011
94-C6H6O-Phenol-Li-Estimated-2011
94-C6H6O-Phenol-Taatjes-2010
96-C2H2Cl2-cis-1,2-Dichloroethylene-Kanno-2007
96-C5H4O2-2-Ethylfuran-Smith-2015
96-C6H8O-2,5-Dimethylfuran-Xie-2010
96-C6H8O-Furfural-Smith-2015
98-C7H14-Methylcyclohexane-Yang-2012
98-C7H14-Methylcyclohexane-Zhou-2010
98-C8H2-1,3,5,7-Octatetrayne-Li-Estimated-2007
99-C6H13N-Cyclohexanamine-Xie-2011
100-C5H8O2-Ethyl propenoate-Wang-2010
100-C5H8O2-Methyl crotonate-Wang-2010
100-C5H8O2-Methyl methacrylate-Wang-2010
100-C7H16-n-Heptane-Adam-2007
100-C7H16-n-Heptane-Zhou-2010
100-C8H4-1-Octene-3,5,7-triyne-Li-Estimated-2007
100-C8H4-3-Octene-1,5,7-triyne-Li-Estimated-2007
101-C6H15N-Triethylamine-Xie-2011
102-C5H10O2-Ethyl propanoate-Wang-2010
102-C5H10O2-Methyl butanoate-Wang-2010
102-C5H10O2-Methyl isobutyrate-Wang-2010
102-C6H14O-Ethyl tert-butyl ether-Xie-2010
102-C8H6-Benzocyclobutadiene-Li-Estimated-2007
102-C8H6-Phenylacetylene-Zhou-2009
103-C7H5N-Benzonitrile-Xie-2011
104-C8H8-Benzocyclobutane-Li-Estimated-2007
104-C8H8-o-Xylylene-Li-Estimated-2011
104-C8H8-p-Xylylene-Li-Estimated-2011
104-C8H8-Styrene-Adam-2007
104-C8H8-Styrene-Kanno-2007
104-C8H8-Styrene-Yoshino-1973
104-C8H8-Styrene-Zhou-2009
104-F4Si-Silicon tetrafluoride-Kameta-1993
105-C8H9-1-Phenylethyl radical-Li-Estimated-2007
105-C8H9-m-Xylyl radical-Li-Estimated-2011
105-C8H9-o-Xylyl radical-Li-Estimated-2011
105-C8H9-p-Xylyl radical-Li-Estimated-2011
106-C7H6O-Benzaldehyde-Zhou-2009
106-C8H10-1,3,5-Cyclooctatriene-Li-Estimated-2007
106-C8H10-Ethylbenzene-Kanno-2007
106-C8H10-Ethylbenzene-Zhou-2009
106-C8H10-m-Xylene-Kanno-2007
106-C8H10-m-Xylene-Zhou-2009
106-C8H10-o-Xylene-Zhou-2009
106-C8H10-p-Xylene-Adam-2007
106-C8H10-p-Xylene-Zhou-2009
107-C7H9N-Benzylamine-Xie-2011
107-C7H9N-N-Methylaniline-Xie-2011
108-C6H4O2-o-Benzoquinone-Yang-Estimated-2011
108-C6H4O2-p-Benzoquinone-Yang-Estimated-2011
108-C7H8O-Benzyl alcohol-Zhou-2009
108-C7H8O-Cresols-Li-Estimated-2011
110-C6H6O2-1,2-Benzenediol-Li-Estimated-2011
110-C6H6O2-1,4-Benzenediol-Yang-Estimated-2011
110-C6H6O2-1,4-Cyclohex-2-enedione-Yang-Estimated-2011
110-C6H6O2-2-Acetylfuran-Smith-2015
112-C6H5Cl-Monochlorobenzene-Adam-2007
112-C6H5Cl-Monochlorobenzene-Kanno-2007
112-C9H4-1,3,5,7-Nonantetrayne-Li-Estimated-2007
114-C8H18-Isooctane-Zhou-2010
114-C8H18-n-Octane-Adam-2007
114-C9H6-C9H6-Yang-Estimated-2011
115-C9H7-Indenyl radical-Li-Estimated-2007
116-C9H8-1-Ethynyl-4-methylbenzene-Li-Estimated-2008
116-C9H8-Indene-Zhou-2009
117-C8H7N-Benzyl nitrile-Xie-2011
118-C9H10-Indane-Zhou-2009
120-C8H8O-Acetophenone-Yang-Estimated-2011
120-C8H8O-Methylbenzaldehydes-Yang-Estimated-2011
120-C9H12-1,3,5-Trimethylbenzene-Kanno-2007
120-C9H12-1,3,5-Trimethylbenzene-Zhou-2009
120-C9H12-n-Propylbenzene-Zhou-2009
122-C10H2-1,3,5,7,9-Decapentayne-Li-Estimated-2007
122-C8H10O-Dimethylphenols-Li-Estimated-2011
123-C6H5NO2-Nitrobenzene-Kanno-2007
123-C6H5NO2-Nitrobenzene-Xie-2011
126-C10H6-1,4-Diethynylbenzene-Li-Estimated-2011
126-C7H7Cl-Benzyl chloride-Kanno-2007
128-C10H8-Azulene-Li-Estimated-2011
128-C10H8-Naphthalene-Li-Estimated-2011
128-C9H20-n-Nonane-Adam-2007
128-C9H20-n-Nonane-Zhou-2010
129-C10H9-2,3-Dihydro-2-naphthalenyl radical-Li-Estimated-2011
129-C8H19N-Dibutylamine-Xie-2011
130-C10H10-(E)-1-Phenyl-1,3-butadiene-Li-Estimated-2011
130-C10H10-1,2-Dihydronaphthalene-Li-Estimated-2011
130-C10H10-2-Butynylbenzene-Li-Estimated-2011
130-C10H10-3-Methylindene-Li-Estimated-2011
130-C2HCl3-Trichloroethylene-Kanno-2007
130-C9H6O-1H-Inden-1-one-Yang-Estimated-2011
131-C10H11-1-Tetralyl radical-Li-Estimated-2011
132-C10H12-(E)-1-Phenyl-1-butene-Li-Estimated-2011
132-C10H12-1,4,5,8-Tetrahydronaphthalene-Li-Unpublished-2011
132-C10H12-2-Methylpropenylbenzene-Li-Estimated-2011
132-C10H12-3-Butenylbenzene-Li-Estimated-2011
132-Xe-Xenon-Samson-2002
132-Xe-Xenon-West-1978
132-Xe-Xenon-Zheng-2006
134-C10H14-n-Butylbenzene-Yang-Estimated-2011
138-C10H18-trans-Decahydronaphthalene-Zhou-2010
139-C11H7-3-Ethynyl-1H-indene radical-Yang-Estimated-2011
140-C11H8-1H-Cyclopropa(b)naphthalene-Li-Estimated-2011
140-C11H8-3-Ethynyl-1H-indene-Yang-Estimated-2011
142-C10H22-n-Decane-Adam-2007
142-C10H22-n-Decane-Zhou-2010
142-C11H10-1-Methylnaphthalene-Zhou-2009
142-C11H10-2-Methylnaphthalene-Li-Estimated-2011
144-C10H8O-Naphthalenols-Li-Estimated-2011
144-C10H8O-Naphthalenols-Yang-Estimated-2011
144-C11H12-1,2,3,4-Tetrahydro-1-methylenenaphthalene-Li-Estimated-2011
144-C11H12-1,2,3,4-Tetrahydro-1-methylenenaphthalene-Yang-Estimated-2011
144-C11H12-Cyclopenten-1-ylbenzene-Yang-Estimated-2011
146-C11H14-1-Pentenylbenzene-Yang-Estimated-2011
146-C11H14-Cyclopentylbenzene-Yang-Estimated-2011
150-C12H6-1,2-Dehydroacenaphthylene-Li-Estimated-2011
152-C12H8-Acenaphthylene-Li-Estimated-2011
152-C12H8-Biphenylene-Li-Estimated-2011
152-C12H8-Ethynylnaphthalenes-Li-Estimated-2011
154-C12H10-1,2-Dihydrocyclobuta(b)naphthalene-Li-Estimated-2011
154-C12H10-1-Ethenylnaphthalene-Li-Estimated-2011
154-C12H10-Acenaphthene-Li-Estimated-2011
154-C12H10-Biphenyl-Li-Estimated-2011
156-C11H24-n-Undecane-Zhou-2010
156-C12H12-1,4-Dimethylnaphthalene-Li-Estimated-2011
165-C13H9-Fluorenyl radical-Yang-Estimated-2011
166-C13H10-1H-Phenalene-Li-Estimated-2011
166-C13H10-Fluorene-Li-Estimated-2011
166-C2Cl4-Tetrachloroethylene-Kanno-2007
168-C13H12-2-Methylbiphenyl-Li-Estimated-2011
168-C13H12-4-Methylbiphenyl-Li-Estimated-2011
168-C13H12-Diphenylmethane-Li-Estimated-2011
170-C12H10O-Acetylnaphthalenes-Yang-Estimated-2011
170-C12H10O-Biphenylols-Yang-Estimated-2011
170-C12H26-n-Dodecane-Zhou-2010
170-SiCl4-Tetrachlorosilane-Kameta-1993
176-C14H8-Diethynylnaphthalenes-Li-Estimated-2011
178-C14H10-Anthracene-Li-Estimated-2011
178-C14H10-Phenanthrene-Li-Estimated-2011
180-C14H12-(E)-Stilbene-Li-Estimated-2011
180-C14H12-(Z)-Stilbene-Li-Estimated-2011
180-C14H12-9,10-Dihydrophenanthrene-Li-Estimated-2011
182-C14H14-2,2'-Dimethylbiphenyl-Yang-Estimated-2011
182-C14H14-3,3'-Dimethylbiphenyl-Li-Estimated-2007
182-C14H14-Bibenzyl-Li-Estimated-2007
184-C13H28-n-Tridecane-Zhou-2010
190-C15H10-4H-Cyclopenta(def)phenanthrene-Li-Estimated-2011
190-C15H10-Cyclopropa(b)anthracene-Li-Estimated-2011
192-C15H12-4-Methylphenanthrene-Li-Estimated-2011
192-C15H12-9-Methylphenanthrene-Li-Estimated-2011
192-C15H12-Methylanthracenes-Li-Estimated-2011
198-C14H30-n-Tetradecane-Zhou-2010
202-C16H10-Pyrene-Li-Estimated-2011
202-C16H10-Pyrene-Verstraete-1990
204-C16H12-2-Phenylnaphthalene-Li-Estimated-2007
212-C15H32-n-Pentadecane-Zhou-2010
216-C17H12-7H-Benzo(de)anthracene-Li-Estimated-2011
216-C17H12-Benzofluorenes-Li-Estimated-2011
220-C6O6Cr-Chromium hexacarbonyl-Qi-1997
226-C16H34-n-Hexadecane-Zhou-2010
226-C18H10-Benzo(ghi)fluoranthene-Li-Estimated-2011
228-C18H12-Benz(a)anthracene-Li-Estimated-2011
228-C18H12-Chrysene-Li-Estimated-2011
240-C19H12-4H-Cyclopenta(def)triphenylene-Li-Estimated-2011
242-C19H14-Methylbenz(a)anthracenes-Li-Estimated-2011
242-C19H14-Methylchrysenes-Li-Estimated-2011
250-C20H10-Corannulene-Li-Estimated-2011
250-C20H10-Dicyclopenta(cd,fg)pyrene-Li-Estimated-2011
252-C20H12-Benzo(e)pyrene-Li-Estimated-2011
252-C20H12-Benzofluoranthene-Li-Estimated-2011
254-C20H14-cC20H14-Li-Estimated-2011
264-C21H12-cC21H12-Li-Estimated-2011
266-C21H14-cC21H14-Li-Estimated-2011
266-C6O6Mo-Molybdenum hexacarbonyl-Qi-1997
300-C24H12-Coronene-Verstraete-1990
352-C6O6W-Tungsten hexacarbonyl-Qi-1997
720-C60-Buckminsterfullerene-Vries-1992
720-C60-Buckminsterfullerene-Yoo-1992
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