@MOLECULE FDBD03072 37 39 0 0 0 SMALL USER_CHARGES @ATOM 1 C 0.0993 1.2668 -0.0602 C.ar 1 UNK -0.0614 2 C1 1.1754 1.9698 -0.5698 C.ar 1 UNK -0.0604 3 C2 2.2985 1.2934 -1.0066 C.ar 1 UNK -0.0431 4 C3 2.3463 -0.0876 -0.9335 C.ar 1 UNK 0.0442 5 C4 1.2697 -0.7903 -0.4231 C.ar 1 UNK -0.0261 6 C5 0.1465 -0.1126 0.0131 C.ar 1 UNK -0.0571 7 C6 1.3207 -2.2943 -0.3435 C.3 1 UNK 0.0105 8 C7 1.6183 -2.7190 1.0959 C.3 1 UNK 0.1529 9 C8 1.7189 -4.2441 1.1672 C.3 1 UNK 0.2386 10 N 0.4576 -4.8382 0.7172 N.am 1 UNK 0.0805 11 C9 -0.6341 -5.0872 1.4709 C.2 1 UNK 0.3798 12 S -0.7933 -4.7602 3.1438 S.2 1 UNK 0.0467 13 N1 -1.5747 -5.6352 0.6833 N.am 1 UNK -0.1992 14 C10 -1.1261 -5.7447 -0.5393 C.2 1 UNK 0.3026 15 N2 0.1411 -5.2568 -0.5859 N.2 1 UNK 0.0166 16 C11 2.9422 -2.0990 1.5473 C.3 1 UNK 0.0803 17 C12 3.9872 -3.0333 2.1602 C.3 1 UNK -0.0292 18 C13 4.1996 -2.4644 0.7559 C.3 1 UNK -0.0292 19 Cl 2.8316 -0.4251 2.2081 Cl 1 UNK -0.1149 20 O 0.5658 -2.2705 1.9521 O.3 1 UNK -0.3800 21 Cl1 3.7567 -0.9379 -1.4825 Cl 1 UNK -0.0833 22 H -0.7394 1.7722 0.2655 H 1 UNK 0.0618 23 H1 1.1398 2.9998 -0.6240 H 1 UNK 0.0618 24 H2 3.1015 1.8181 -1.3873 H 1 UNK 0.0632 25 H3 -0.6569 -0.6368 0.3936 H 1 UNK 0.0621 26 H4 2.0912 -2.6597 -0.9897 H 1 UNK 0.0344 27 H5 0.3783 -2.6997 -0.6474 H 1 UNK 0.0344 28 H6 1.9134 -4.5419 2.1763 H 1 UNK 0.1119 29 H7 2.5159 -4.5789 0.5366 H 1 UNK 0.1119 30 H8 -2.4702 -5.9134 0.9831 H 1 UNK 0.1635 31 H9 -1.6485 -6.1372 -1.3381 H 1 UNK 0.1634 32 H10 0.7236 -5.2065 -1.3780 H 1 UNK 0.5388 33 H11 3.7661 -4.0723 2.2887 H 1 UNK 0.0283 34 H12 4.5553 -3.0420 3.0669 H 1 UNK 0.0283 35 H13 4.9574 -1.7284 0.5858 H 1 UNK 0.0283 36 H14 4.3906 -2.8842 -0.2096 H 1 UNK 0.0283 37 H15 -0.2735 -2.6636 1.6659 H 1 UNK 0.2105 @BOND 1 1 6 ar 2 1 2 ar 3 2 3 ar 4 3 4 ar 5 4 5 ar 6 4 21 1 7 5 6 ar 8 5 7 1 9 7 8 1 10 8 9 1 11 8 16 1 12 8 20 1 13 9 10 1 14 10 15 1 15 10 11 1 16 11 12 2 17 11 13 1 18 13 14 1 19 14 15 2 20 16 18 1 21 16 17 1 22 16 19 1 23 17 18 1 24 1 22 1 25 2 23 1 26 3 24 1 27 6 25 1 28 7 26 1 29 7 27 1 30 9 28 1 31 9 29 1 32 13 30 1 33 14 31 1 34 15 32 1 35 17 33 1 36 17 34 1 37 18 35 1 38 18 36 1 39 20 37 1