Benzene C 2.1979970053 -0.28556144 1.375 C 0.851695035298 -0.64630197 1.375 C 2.5587375353 1.06074053 1.375 C 0.226874125298 1.68556144 1.375 C 1.5731760953 2.04630197 1.375 C -0.133866404702 0.33925947 1.375 H 2.9638726753 -1.05143711 1.375 H 0.571365095298 -1.69250758 1.375 H -1.1800720147 0.05892953 1.375 H -0.539001544702 2.45143711 1.375 H 1.8535060353 3.09250758 1.375 H 3.6049431453 1.34107047 1.375 Benzonitrile C -0.0000000 -2.2353307 0.0000000 C -1.2089860 -1.5412817 0.0000000 C 1.2089860 -1.5412817 0.0000000 C 0.0000000 0.5412353 0.0000000 C 1.2152380 -0.1511037 0.0000000 C -1.2152380 -0.1511037 0.0000000 C 0.0000000 1.9810173 0.0000000 N 0.0000000 3.1372073 0.0000000 H -2.1464810 -2.0822627 0.0000000 H 2.1464810 -2.0822627 0.0000000 H 2.1458220 0.4009713 0.0000000 H -2.1458220 0.4009713 0.0000000 H -0.0000000 -3.3181557 0.0000000 Phenol C 0.0024166 0.9146867 0.0000000 C -1.2085054 0.2240279 0.0000000 C 1.2103706 0.2198719 0.0000000 C -0.0004038 -1.8744078 0.0000000 C 1.2021883 -1.1737736 0.0000000 C -1.2025839 -1.1658888 0.0000000 H 2.1503356 0.7622997 0.0000000 H 2.1441780 -1.7085654 0.0000000 H -2.1451592 -1.6996750 0.0000000 H -2.1317427 0.7888807 0.0000000 O -0.0562187 2.2801417 0.0000000 H 0.8360860 2.6473116 0.0000000 H -0.0028142 -2.9567350 0.0000000 Toluene C -0.0000000 -1.3685822 0.0000000 C 1.2031408 -0.6662629 0.0000000 C -1.2031408 -0.6662629 -0.0000000 C 0.0000000 1.4423339 -0.0000000 C 0.0000000 2.9509749 0.0000000 C -1.1999683 0.7267989 -0.0000000 C 1.1999683 0.7267989 0.0000000 H -2.1448169 -1.2020743 -0.0000000 H 2.1448169 -1.2020743 0.0000000 H -2.1406543 1.2671423 -0.0000000 H 2.1406543 1.2671423 0.0000000 H -0.0000000 -2.4517116 0.0000000 H 0.0000000 3.5690525 0.8828918 H 0.8828918 3.5690525 -0.6463216 H -0.8828918 3.5690525 -0.6463216 Thiophene C 0.7128672897 1.2610733639 0.0 C 1.2305420343 0.0002810467 0.0 C -0.7128672897 1.2610733639 0.0 C -1.2305420343 0.0002810467 0.0 S 0.0000000000 -1.1844258642 0.0 H 1.3219379212 2.1569579094 0.0 H 2.2714145019 -0.2912350355 0.0 H -1.3219379212 2.1569579094 0.0 H -2.2714145019 -0.2912350355 0.0 Pyridine C 1.1932263421 -0.6745524814 0.0000000000 C 0.0000000000 -1.3836245033 0.0000000000 C -1.1932263421 -0.6745524814 0.0000000000 C 1.1377834817 0.7141903482 0.0000000000 N 0.0000000000 1.4071490075 0.0000000000 C -1.1377834817 0.7141903482 0.0000000000 H 2.1513990038 -1.1832054433 0.0000000000 H 0.0000000000 -2.4694228166 0.0000000000 H -2.1513990038 -1.1832054433 0.0000000000 H 2.0544304572 1.3002088756 0.0000000000 H -2.0544304572 1.3002088756 0.0000000000 Triazine C 0.6446573385 -1.1165792638 0.0000000000 N 1.3662708071 0.0000000000 0.0000000000 C 0.6446573385 1.1165792638 0.0000000000 N -0.6831354036 1.1832252274 0.0000000000 C -1.2893146770 0.0000000000 0.0000000000 N -0.6831354036 -1.1832252274 0.0000000000 H 1.1886790275 -2.0588524696 0.0000000000 H 1.1886790275 2.0588524696 0.0000000000 H -2.3773580551 0.0000000000 0.0000000000 Nitrobenzene C 0.0000000000 -1.364748405 0.0000000000 C -1.219515 -0.700108119 0.0000000000 C 1.219515 -0.700108119 0.0000000000 C 0.0000000000 1.383590881 0.0000000000 C -1.2100020 0.690686881 0.0000000000 C 1.2100020 0.690686881 0.0000000000 H -2.1471640 1.231948881 0.0000000000 H -2.139889 -1.265712119 0.0000000000 H 2.139889 -1.265712119 0.0000000000 H 2.147164 1.231948881 0.0000000000 O -1.077996 -3.399089119 0.0000000000 O 1.077996 -3.399089119 0.0000000000 N 0.0000000000 -2.835432119 0.0000000000 H 0.0000000000 2.466141881 0.0000000000