@MOLECULE FDBD01234 30 31 0 0 0 SMALL GASTEIGER @ATOM 1 S -0.4009 2.2821 0.1007 S.O2 1 UNK 0.0746 2 O -1.1139 3.1820 0.9995 O.2 1 UNK -0.1499 3 O1 -0.0669 2.7476 -1.2398 O.2 1 UNK -0.1499 4 N 1.0302 1.7512 0.8998 N.pl3 1 UNK -0.1836 5 N1 1.7323 -0.4930 1.0884 N.ar 1 UNK -0.2185 6 N2 2.3186 0.8216 -0.8442 N.ar 1 UNK -0.2217 7 N3 -3.5870 -2.7175 -0.3590 N.pl3 1 UNK -0.3580 8 C -1.3362 0.8140 -0.0343 C.ar 1 UNK 0.1087 9 C1 -2.2224 0.4558 0.9816 C.ar 1 UNK -0.0333 10 C2 -1.1974 -0.0009 -1.1580 C.ar 1 UNK -0.0333 11 C3 -2.8308 -1.5319 -0.2494 C.ar 1 UNK 0.0247 12 C4 -2.9696 -0.7172 0.8740 C.ar 1 UNK -0.0392 13 C5 -1.9446 -1.1737 -1.2655 C.ar 1 UNK -0.0392 14 C6 1.7357 0.6259 0.3481 C.ar 1 UNK 0.2349 15 C7 2.4032 -1.5280 0.5419 C.ar 1 UNK 0.0433 16 C8 3.0480 -1.4660 -0.6767 C.ar 1 UNK -0.0224 17 C9 2.9716 -0.2538 -1.3316 C.ar 1 UNK 0.0329 18 C10 2.4302 -2.7982 1.3244 C.3 1 UNK -0.0222 19 H 1.3556 2.2050 1.7106 H 1 UNK 0.1767 20 H1 -4.2125 -2.9705 0.3580 H 1 UNK 0.1423 21 H2 -3.4894 -3.2921 -1.1525 H 1 UNK 0.1423 22 H3 -2.3253 1.0586 1.8129 H 1 UNK 0.0638 23 H4 -0.5419 0.2640 -1.9097 H 1 UNK 0.0638 24 H5 -3.6251 -0.9822 1.6257 H 1 UNK 0.0636 25 H6 -1.8419 -1.7765 -2.0968 H 1 UNK 0.0636 26 H7 3.5543 -2.2735 -1.0724 H 1 UNK 0.0651 27 H8 3.4407 -0.1647 -2.2465 H 1 UNK 0.0831 28 H9 1.8846 -2.6675 2.2355 H 1 UNK 0.0293 29 H10 3.4437 -3.0569 1.5496 H 1 UNK 0.0293 30 H11 1.9816 -3.5810 0.7492 H 1 UNK 0.0293 @BOND 1 1 2 2 2 1 3 2 3 1 4 1 4 1 8 1 5 4 14 1 6 5 14 ar 7 5 15 ar 8 6 14 ar 9 6 17 ar 10 7 11 1 11 8 9 ar 12 8 10 ar 13 9 12 ar 14 10 13 ar 15 11 12 ar 16 11 13 ar 17 15 16 ar 18 15 18 1 19 16 17 ar 20 4 19 1 21 7 20 1 22 7 21 1 23 9 22 1 24 10 23 1 25 12 24 1 26 13 25 1 27 16 26 1 28 17 27 1 29 18 28 1 30 18 29 1 31 18 30 1