@MOLECULE FDBD03116 13 14 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.0177 1.4563 0.0100 C.3 1 UNK 0.1060 2 C1 1.4640 1.8468 -0.0020 C.3 1 UNK 0.1742 3 N 2.1895 0.5299 -0.0160 N.ar 1 UNK -0.1540 4 C2 1.2450 -0.4454 -0.0122 C.ar 1 UNK 0.3495 5 N1 0.0021 -0.0041 0.0020 N.2 1 UNK -0.2111 6 S 1.9952 -2.0624 -0.0281 S.2 1 UNK 0.0448 7 S1 3.9405 -1.3601 -0.0429 S.2 1 UNK 0.0324 8 C3 3.5153 0.2941 -0.0295 C.ar 1 UNK 0.3019 9 S2 4.6792 1.5496 -0.0346 S.2 1 UNK 0.0313 10 H -0.5012 1.8254 0.8903 H 1 UNK 0.0574 11 H1 -0.5583 1.8655 -0.8178 H 1 UNK 0.0574 12 H2 1.7156 2.4099 0.8723 H 1 UNK 0.1051 13 H3 1.7192 2.4654 -0.8369 H 1 UNK 0.1051 @BOND 1 1 5 1 2 1 2 1 3 2 3 1 4 3 8 ar 5 3 4 ar 6 4 5 2 7 4 6 ar 8 6 7 ar 9 7 8 ar 10 8 9 2 11 1 10 1 12 1 11 1 13 2 12 1 14 2 13 1