,Environment,Molecule,SMILES,"Theta_s ("")",T_rot (K),Ncol - reported (cm-2),v_lsr (km s-1),dv (km s-1),Isotopologue,Environment code,Excited State,Ncol - predicted (log10 cm-2),split
0,Hot Core,C2H3CN_0,C=CC#N,20,130,750000000000000,3.5,12.5,0,0,0,15.66301983,train
1,Hot Core,C2H3CN_1,C=CC#N,10,215,2.7E+15,5,5.5,0,0,0,15.73858041,train
2,Hot Core,C2H5CN_0,CCC#N,10,136,2.10E+16,5,7,0,0,0,16.40253072,train
3,Hot Core,C2H5CN_1,CCC#N,5,300,6.5E+15,5,7,0,0,0,16.3357493,train
4,Hot Core,CH2NH,C=N,10,130,1.3E+15,6,8,0,0,0,14.90266829,test
5,Hot Core,CH3CN_v8|1,CC#N,10,260,3.7E+15,6,6,0,0,1,15.84420376,train
6,Hot Core,(13^C)H3CN_0,[13CH3]C#N,20,80,80000000000000,5.5,8,1,0,0,13.7714897,train
7,Hot Core,(13^C)H3CN_1,[13CH3]C#N,10,260,130000000000000,5.5,8,1,0,0,13.61961153,train
8,Hot Core,CH3(13^C)N_0,C[13C]#N,20,80,80000000000000,5.5,8,1,0,0,13.77948768,train
9,Hot Core,CH3(13^C)N_1,C[13C]#N,10,260,130000000000000,5.5,8,1,0,0,13.87292755,train
10,Hot Core,C(18^O),[C-]#[18O+],10,150,1.90E+17,6,9,1,0,0,16.98344056,train
11,Hot Core,C(17^O),[C-]#[17O+],10,150,6.30E+16,6,9,1,0,0,16.48170831,train
12,Hot Core,H2O_v2|1,O,5,270,1.70E+19,5.5,7,0,0,1,19.01652995,train
13,Hot Core,H2(17^O),[17OH2],5,270,5.5E+15,4.8,7,1,0,0,15.55381506,train
14,Hot Core,HDO,[2H]O[H],5,270,3.00E+16,5,7,1,0,0,16.37262226,train
15,Hot Core,H2(34^S),[34SH2],6,145,3.80E+16,4.5,8.6,1,0,0,16.21539511,train
16,Hot Core,H2(33^S),[33SH2],6,145,1.10E+16,4.5,8.6,1,0,0,14.93056816,test
17,Hot Core,HC3N_0,C#CC#N,20,10,1E+15,5.5,6.5,0,0,0,14.96495787,test
18,Hot Core,HC3N_1,C#CC#N,10,210,1.5E+15,5.5,6.5,0,0,0,15.74538792,train
19,Hot Core,HC3N_v7|1_0,C#CC#N,20,10,1E+15,5.5,6.5,0,0,1,14.96765686,train
20,Hot Core,HC3N_v7|1_1,C#CC#N,10,210,1.5E+15,5.5,6.5,0,0,1,16.00713982,test
21,Hot Core,HCN_v2|2,C#N,10,217,4.70E+17,6,7,0,0,2,17.62541553,train
22,Hot Core,H(13^C)N_v2|1,[13CH]#N,10,157,3.50E+16,5.5,6,1,0,1,16.74240259,train
23,Hot Core,HC(15^N)_0,C#[15N],20,20,150000000000000,4.5,10,1,0,0,14.37257719,train
24,Hot Core,HC(15^N)_1,C#[15N],10,210,350000000000000,4.5,10,1,0,0,15.03633042,test
25,Hot Core,DCN_0,[2H]C#N,20,20,90000000000000,6,8,0,0,0,13.80714781,train
26,Hot Core,DCN_1,[2H]C#N,10,210,160000000000000,5.5,8,0,0,0,14.44291646,train
27,Hot Core,H(13^C)O+,[13CH]=[O+],10,190,9000000000000,6,10,1,0,0,13.69239439,test
28,Hot Core,HNC_v2|1,[C-]#[NH+],10,220,1.3E+15,4.5,7,0,0,1,15.2241622,train
29,Hot Core,HN(13^C)_0,[13C-]#[NH+],20,15,3000000000000,2.5,8.5,1,0,0,12.78262303,train
30,Hot Core,HN(13^C)_1,[13C-]#[NH+],10,220,35000000000000,2.5,8.5,1,0,0,13.23864083,train
31,Hot Core,HN(13^C)O_0,O=[13C]=N,20,30,45000000000000,6.3,6.2,1,0,0,13.46784643,train
32,Hot Core,HN(13^C)O_1,O=[13C]=N,10,209,490000000000000,6.3,6.2,1,0,0,14.43619624,train
33,Hot Core,o-NH2,[NH2],10,130,1.3E+15,6,12,0,0,0,15.12864701,train
34,Hot Core,NH3_v2|1,N,10,250,1.30E+17,6,5.5,0,0,1,16.64447612,train
35,Hot Core,(15^N)H3,[15NH3],10,200,1E+15,5,5.5,1,0,0,15.23119629,train
36,Hot Core,NH2D,N[2H],10,250,3.9E+15,6.2,6,0,0,0,15.21422732,train
37,Hot Core,NO,[N]=O,10,180,1.70E+17,6,8,0,0,0,16.15952394,test
38,Hot Core,NS,[N]=S,10,105,2.1E+15,4.2,10.5,0,0,0,15.63185994,train
39,Hot Core,OCS,O=C=S,10,190,3.20E+16,6,8,0,0,0,16.76116892,train
40,Hot Core,(34^S)O_0,O=[34S],20,70,450000000000000,4.5,7,1,0,0,14.80025215,train
41,Hot Core,(34^S)O_1,O=[34S],10,258,1.8E+15,4.5,7,1,0,0,15.1048187,train
42,Hot Core,(33^S)O_0,O=[33S],20,70,230000000000000,4.5,7,1,0,0,14.75608297,test
43,Hot Core,(33^S)O_1,O=[33S],10,258,500000000000000,4.5,7,1,0,0,14.74007945,train
44,Hot Core,SO2_v2|1,O=S=O,10,240,9.00E+16,6,7,0,0,1,16.76019063,test
45,Hot Core,(34^S)O2_0,O=[34S]=O,20,50,1.1E+15,5,8,1,0,0,14.80017361,train
46,Hot Core,(34^S)O2_1,O=[34S]=O,10,240,5E+15,5,8,1,0,0,15.27437647,train
47,Hot Core,(33^S)O2_0,O=[33S]=O,20,50,260000000000000,5,8,1,0,0,14.7020128,train
48,Hot Core,(33^S)O2_1,O=[33S]=O,10,240,1.3E+15,5,8,1,0,0,14.98216899,train
49,Hot Core (S),CCH,[C]#C,10,53,2.3E+15,7,13.5,0,1,0,15.64145309,train
50,Hot Core (S),CH3OCH3,COC,10,100,2.10E+16,7.2,10,0,1,0,16.72269872,test
51,Hot Core (S),(13^C)H3OH,[13CH3]O,10,128,1.50E+16,7.5,6.5,1,1,0,15.64203524,train
52,Hot Core (S),CH3OD_A,CO[2H],10,128,780000000000000,7.5,6.5,0,1,0,15.0194723,train
53,Hot Core (S),CH3OD_E,CO[2H],10,128,780000000000000,7.5,6.5,0,1,0,15.0194723,train
54,Hot Core (S),CH2DOH,[2H]CO,10,128,1.3E+15,7.5,6.5,0,1,0,14.94351541,train
55,Hot Core (S),(13^C)S,[S+]#[13C-],10,100,970000000000000,6.5,10.5,1,1,0,14.73539553,train
56,Hot Core (S),C(34^S),[34S+]#[C-],10,100,1.9E+15,6.5,10.5,1,1,0,15.04117483,train
57,Hot Core (S),C(33^S),[33S+]#[C-],10,100,640000000000000,6.5,10.5,1,1,0,14.91670303,train
58,Hot Core (S),H2(13^C)O,[13C]=O,10,135,850000000000000,6.5,13,1,1,0,14.78385709,train
59,Hot Core (S),H2CS,C=S,10,120,4.6E+15,7.5,7.5,0,1,0,15.95243257,test
60,Hot Core (S),HD(18^O),[2H][18OH],3,100,1.3E+15,6.5,6,1,1,0,14.48859037,train
61,Hot Core (S),D2O,[2H]O[2H],3,100,700000000000000,6.5,6,0,1,0,15.80366184,test
62,Compact Ridge,C2H5OH,CCO,10,110,6.5E+15,7.8,2.5,0,2,0,15.8752362,train
63,Compact Ridge,CH3CN_v8|1,CC#N,10,230,3.5E+15,7.5,4,0,2,1,15.70129996,test
64,Compact Ridge,(13^C)H3CN,[13CH3]C#N,10,230,110000000000000,7.5,4,1,2,0,13.91119612,train
65,Compact Ridge,CH3(13^C)N,C[13C]#N,10,230,110000000000000,7.5,4,1,2,0,13.96815176,train
66,Compact Ridge,CH3OCH3,COC,10,110,6.50E+16,8,3.2,0,2,0,16.90919563,train
67,Compact Ridge,CH3OCHO,O=COC,10,110,1.30E+17,8,2.8,0,2,0,17.38341702,train
68,Compact Ridge,(13^C)H3OH,[13CH3]O,10,140,1.00E+16,7.8,2.5,1,2,0,15.54194815,train
69,Compact Ridge,CH3OD_A,CO[2H],10,140,1.7E+15,7.8,2.5,0,2,0,15.37505981,train
70,Compact Ridge,CH3OD_E,CO[2H],10,140,1.7E+15,7.8,2.5,0,2,0,15.37505981,train
71,Compact Ridge,CH2DOH,[2H]CO,10,140,8.1E+15,7.8,2.5,0,2,0,15.18386461,train
72,Compact Ridge,C(18^O),[C-]#[18O+],10,125,1.30E+17,8,4,1,2,0,16.71415884,train
73,Compact Ridge,C(17^O),[C-]#[17O+],10,125,2.00E+16,8,4,1,2,0,15.7894481,train
74,Compact Ridge,(13^C)(18^O),[13C-]#[18O+],10,125,2.5E+15,8,4,1,2,0,15.25910288,train
75,Compact Ridge,(13^C)S,[S+]#[13C-],10,225,200000000000000,7.2,4,1,2,0,14.2657723,train
76,Compact Ridge,C(34^S),[34S+]#[C-],10,225,250000000000000,7.2,4,1,2,0,14.39100639,train
77,Compact Ridge,C(33^S),[33S+]#[C-],10,225,130000000000000,7.2,4,1,2,0,14.29059309,train
78,Compact Ridge,H2CCO,O=C=C,10,100,2E+15,8,3,0,2,0,15.00619091,train
79,Compact Ridge,H2(13^C)O,[13CH2]=O,15,50,380000000000000,8,3.5,1,2,0,14.87278304,train
80,Compact Ridge,HDCO_0,[2H]C=O,12,60,180000000000000,10,2.2,0,2,0,14.09612782,train
81,Compact Ridge,HDCO_1,[2H]C=O,12,60,260000000000000,7.7,2.2,0,2,0,14.48648407,train
82,Compact Ridge,H2CS,C=S,10,100,2.9E+15,8,3,0,2,0,15.48399265,train
83,Compact Ridge,H2(17^O),[17OH2],5,150,900000000000000,8,3,1,2,0,14.81857833,train
84,Compact Ridge,HDO,[2H]O[H],5,150,3.5E+15,8,3,0,2,0,15.38945629,train
85,Compact Ridge,H(13^C)N,[13CH]#N,10,120,36000000000000,8,4,1,2,0,13.69409066,train
86,Compact Ridge,DCN,[2H]C#N,10,120,17000000000000,8,4,0,2,0,13.56911678,train
87,Compact Ridge,H(13^C)O+,[13CH]=[O+],20,100,3000000000000,9,5.5,1,2,0,12.73097065,train
88,Compact Ridge,HCS+,C=[S+],10,105,180000000000000,9,6,0,2,0,14.65167085,train
89,Compact Ridge,HNC,[C-]#[NH+],10,80,65000000000000,9,3,0,2,0,14.20085364,train
90,Compact Ridge,NH2CHO,O=CN,10,190,750000000000000,7.2,4.8,0,2,0,14.60173926,train
91,Compact Ridge,NO,[N]=O,10,70,3.20E+16,7.2,2.5,0,2,0,15.95236702,train
92,Compact Ridge,NS,[N]=S,10,200,610000000000000,7.7,5.5,0,2,0,15.65101116,test
93,Compact Ridge,OCS,O=C=S,10,165,4.3E+15,7.5,2.5,0,2,0,15.8143985,train
94,Compact Ridge,OD,[O][2H],10,125,250000000000000,8,3.5,0,2,0,14.19356951,train
95,Compact Ridge,SO2,O=S=O,10,100,1.8E+15,8.2,3,0,2,0,15.87352781,test
96,Plateau,CH3CN_v8|1,CC#N,30,120,1.00E+16,6,18,0,3,1,15.79406899,train
97,Plateau,(13^C)H3CN,[13CH3]C#N,30,120,65000000000000,6,18,1,3,0,13.99228434,train
98,Plateau,CH3(13^C)N,C[13C]#N,30,120,65000000000000,6,18,1,3,0,14.02688564,test
99,Plateau,CN,[C]#N,30,43,630000000000000,8,20,0,3,0,15.16635657,train
100,Plateau,C(18^O),[C-]#[18O+],30,130,1.30E+17,8.5,25,1,3,0,16.69239274,train
101,Plateau,C(17^O),[C-]#[17O+],30,130,3.70E+16,8.5,25,1,3,0,15.77858266,test
102,Plateau,(13^C)S_0,[S+]#[13C-],30,30,61000000000000,8.7,26.7,1,3,0,13.54208961,train
103,Plateau,(13^C)S_1,[S+]#[13C-],30,155,28000000000000,8.7,26.7,1,3,0,13.55928536,test
104,Plateau,C(34^S)_0,[34S+]#[C-],30,30,150000000000000,8.7,26.7,1,3,0,13.70614885,train
105,Plateau,C(34^S)_1,[34S+]#[C-],30,155,64000000000000,8.7,26.7,1,3,0,13.88287044,train
106,Plateau,C(33^S)_0,[33S+]#[C-],30,30,50000000000000,8.7,26.7,1,3,0,13.53340455,train
107,Plateau,C(33^S)_1,[33S+]#[C-],30,155,17000000000000,8.7,26.7,1,3,0,13.55032868,train
108,Plateau,H2CO_0,C=O,30,20,1.1E+15,8,32,0,3,0,14.64020915,test
109,Plateau,H2CO_1,C=O,30,88,3.5E+15,8,23,0,3,0,15.49286257,train
110,Plateau,H2(17^O),[17OH2],30,150,2.3E+15,9,25,1,3,0,15.31246713,train
111,Plateau,HDO,[2H]O[H],30,150,1.5E+15,9,25,0,3,0,15.19225928,test
112,Plateau,H2(34^S)_0,[34SH2],30,12,2.1E+15,9,30,1,3,0,14.79121553,train
113,Plateau,H2(34^S)_1,[34SH2],30,115,2.5E+15,9,30,1,3,0,15.25556962,train
114,Plateau,H2(33^S)_0,[33SH2],30,12,560000000000000,9,30,1,3,0,13.60360887,test
115,Plateau,H2(33^S)_1,[33SH2],30,115,750000000000000,9,30,1,3,0,13.72264317,train
116,Plateau,HC3N,C#CC#N,30,115,1.3E+15,5.5,23,0,3,0,15.34661973,train
117,Plateau,HC3N_v7|1,C#CC#N,30,115,3E+15,5.5,23,0,3,1,15.60837164,train
118,Plateau,HCl,Cl,50,73,1.4E+15,11.5,25,0,3,0,15.41762451,train
119,Plateau,H(37^Cl),[37ClH],50,73,490000000000000,11.5,25,1,3,0,14.57497857,test
120,Plateau,HC(15^N)_0,C#[15N],30,25,230000000000000,7.5,28,1,3,0,13.9541027,test
121,Plateau,HC(15^N)_1,C#[15N],30,130,100000000000000,8.5,28,1,3,0,14.11717581,train
122,Plateau,DCN_0,[2H]C#N,30,25,35000000000000,5.5,20,0,3,0,13.58083386,train
123,Plateau,DCN_1,[2H]C#N,30,130,32000000000000,8.5,20,0,3,0,13.35839301,train
124,Plateau,H(13^C)O+_0,[13CH]=[O+],30,25,15000000000000,9,50,1,3,0,13.16464912,train
125,Plateau,H(13^C)O+_1,[13CH]=[O+],30,135,1700000000000,8.5,30,1,3,0,12.1898654,train
126,Plateau,HN(13^C)_0,[13C-]#[NH+],30,20,10000000000000,7.5,28,1,3,0,12.93477883,train
127,Plateau,HN(13^C)_1,[13C-]#[NH+],30,115,4300000000000,7.5,25,1,3,0,13.71645575,test
128,Plateau,HN(13^C)O_0,O=[13C]=N,30,25,20000000000000,9,20,1,3,0,13.16097378,train
129,Plateau,HN(13^C)O_1,O=[13C]=N,30,168,43000000000000,9,20,1,3,0,13.40045729,train
130,Plateau,(15^N)H3,[15NH3],30,35,95000000000000,6,15,1,3,0,13.99282539,train
131,Plateau,NO,[N]=O,30,155,1.50E+17,8,27,0,3,0,15.59406621,test
132,Plateau,OCS,O=C=S,30,110,1.20E+16,5,21,0,3,0,16.0386417,train
133,Plateau,(29^Si)O_0,[29Si]=O,30,25,150000000000000,10,35,1,3,0,13.61806841,test
134,Plateau,(29^Si)O_1,[29Si]=O,30,120,48000000000000,10,35,1,3,0,13.45062893,train
135,Plateau,(29^Si)O_2,[29Si]=O,30,18,100000000000000,8,15,1,3,0,14.10338921,train
136,Plateau,(29^Si)O_3,[29Si]=O,30,270,52000000000000,7,15,1,3,0,13.65709122,train
137,Plateau,(30^Si)O_0,[30Si]=O,30,25,160000000000000,10,35,1,3,0,13.50663889,test
138,Plateau,(30^Si)O_1,[30Si]=O,30,120,30000000000000,10,35,1,3,0,13.63036953,train
139,Plateau,(30^Si)O_2,[30Si]=O,30,18,67000000000000,8,15,1,3,0,13.75354494,train
140,Plateau,(30^Si)O_3,[30Si]=O,30,270,41000000000000,7,15,1,3,0,14.29963143,train
141,Plateau,SiS,[Si]=S,30,145,430000000000000,8.5,23,0,3,0,14.80587268,train
142,Plateau,(34^S)O_0,[34S]=O,30,65,4.6E+15,10,26,1,3,0,15.42159557,train
143,Plateau,(34^S)O_1,[34S]=O,30,163,3E+15,10,26,1,3,0,15.44702488,train
144,Plateau,(33^S)O_0,[33S]=O,30,65,1.1E+15,10,26,1,3,0,14.18554094,test
145,Plateau,(33^S)O_1,[33S]=O,30,163,750000000000000,10,26,1,3,0,14.0774111,test
146,Plateau,(34^S)O2_0,O=[34S]=O,30,20,300000000000000,9.5,30,1,3,0,14.49413192,test
147,Plateau,(34^S)O2_1,O=[34S]=O,30,50,2.5E+15,9.5,30,1,3,0,15.26007016,train
148,Plateau,(34^S)O2_2,O=[34S]=O,30,150,4.7E+15,9.5,23,1,3,0,15.49705908,train
149,Plateau,(33^S)O2_0,O=[33S]=O,30,20,71000000000000,9.5,30,1,3,0,14.02018965,train
150,Plateau,(33^S)O2_1,O=[33S]=O,30,50,590000000000000,9.5,30,1,3,0,14.65197493,train
151,Plateau,(33^S)O2_2,O=[33S]=O,30,150,980000000000000,9.5,23,1,3,0,14.69017722,train
152,Extended Ridge,CCH,[C]#C,180,37,450000000000000,8.8,3.5,0,4,0,14.66308583,train
153,Extended Ridge,CH2NH,C=N,180,40,20000000000000,9,4,0,4,0,13.15931437,train
154,Extended Ridge,CN,[C]#N,180,21,220000000000000,9,3.5,0,4,0,14.24071334,test
155,Extended Ridge,C(18^O),[C-]#[18O+],180,40,1.40E+16,9,3,1,4,0,15.90568485,test
156,Extended Ridge,C(17^O),[C-]#[17O+],180,40,6.2E+15,9,3,1,4,0,15.47767939,train
157,Extended Ridge,(13^C)(18^O),[13C-]#[18O+],180,40,230000000000000,9,3,1,4,0,14.57350322,train
158,Extended Ridge,(13^C)S,[S+]#[13C-],180,35,25000000000000,8,4,1,4,0,13.43683058,train
159,Extended Ridge,C(34^S),[34S+]#[C-],180,35,42000000000000,8,4,1,4,0,13.45073219,train
160,Extended Ridge,C(33^S),[33S+]#[C-],180,35,8500000000000,8,4,1,4,0,12.98863555,train
161,Extended Ridge,H2S,S,180,50,100000000000000,8.6,3,0,4,0,14.02509148,train
162,Extended Ridge,HC(15^N),C#[15N],180,30,10000000000000,8.5,4,1,4,0,12.95101127,train
163,Extended Ridge,DCN,[2H]C#N,180,30,9500000000000,8.5,4,0,4,0,12.73831895,train
164,Extended Ridge,H(13^C)O+,[13CH]=[O+],180,27,5300000000000,9,4.5,1,4,0,12.28759706,train
165,Extended Ridge,HN(13^C),[13C-]#[NH+],180,20,1200000000000,8,3,1,4,0,12.57127393,train
166,Extended Ridge,o-NH2,[NH2],180,50,20000000000000,8,3,0,4,0,14.05545028,train
167,Extended Ridge,(15^N)H3,[15NH3],180,23,5300000000000,8.2,3,1,4,0,12.72896608,train
168,Extended Ridge,NO,[N]=O,180,60,7.5E+15,10,5,0,4,0,15.9595171,train
169,Extended Ridge,OCS,O=C=S,180,10,2E+15,7.5,2.5,0,4,0,14.92844155,test
170,Extended Ridge,SO,S=O,180,60,780000000000000,10.5,5,0,4,0,14.65942555,train
171,Extended Ridge,SO2,O=S=O,180,50,300000000000000,8.2,3,0,4,0,15.79035081,test