@MOLECULE FDBD00043 35 36 0 0 0 SMALL GASTEIGER @ATOM 1 S 1.9482 -1.4031 1.1960 S.2 1 UNK -0.0273 2 O 6.4560 0.0914 0.4466 O.3 1 UNK -0.3947 3 N 0.6647 -0.1068 -0.4941 N.ar 1 UNK -0.1903 4 N1 -3.7201 -0.8639 0.0404 N.ar 1 UNK -0.2176 5 N2 -3.3468 1.4253 0.6944 N.ar 1 UNK -0.2400 6 N3 -2.1229 -2.0011 -1.2937 N.pl3 1 UNK -0.3427 7 C 1.8552 0.5579 -0.4189 C.ar 1 UNK 0.1915 8 C1 -0.4220 0.3112 -1.3825 C.3 1 UNK 0.1811 9 C2 2.7054 -0.0313 0.4863 C.ar 1 UNK 0.0636 10 C3 4.0761 0.3463 0.8836 C.3 1 UNK 0.0079 11 C4 -1.7205 0.2785 -0.6599 C.ar 1 UNK 0.0747 12 C5 0.5294 -1.1531 0.2735 C.ar 1 UNK 0.2109 13 C6 2.0649 1.7455 -1.2600 C.3 1 UNK 0.0216 14 C7 5.1629 -0.3197 0.0205 C.3 1 UNK 0.0489 15 C8 -2.5409 -0.8301 -0.6145 C.ar 1 UNK 0.1289 16 C9 -2.1791 1.3888 0.0193 C.ar 1 UNK 0.0421 17 C10 -4.0566 0.2813 0.6640 C.ar 1 UNK 0.1280 18 C11 -5.3540 0.2828 1.3990 C.3 1 UNK -0.0046 19 H 7.1294 -0.3357 -0.1057 H 1 UNK 0.2094 20 H1 -2.6879 -2.8072 -1.2785 H 1 UNK 0.1437 21 H2 -1.2674 -2.0087 -1.7809 H 1 UNK 0.1437 22 H3 -0.4677 -0.3523 -2.2207 H 1 UNK 0.1087 23 H4 -0.2342 1.3105 -1.7158 H 1 UNK 0.1087 24 H5 4.2266 0.0571 1.9027 H 1 UNK 0.0343 25 H6 4.1664 1.4039 0.7483 H 1 UNK 0.0343 26 H7 -0.3141 -1.7460 0.3179 H 1 UNK 0.1462 27 H8 1.1901 1.9239 -1.8497 H 1 UNK 0.0336 28 H9 2.9028 1.5822 -1.9052 H 1 UNK 0.0336 29 H10 2.2545 2.5947 -0.6372 H 1 UNK 0.0336 30 H11 5.0831 -1.3828 0.1117 H 1 UNK 0.0560 31 H12 5.0241 -0.0265 -0.9992 H 1 UNK 0.0560 32 H13 -1.5955 2.2399 0.0104 H 1 UNK 0.0836 33 H14 -5.8205 -0.6752 1.3011 H 1 UNK 0.0308 34 H15 -5.9951 1.0352 0.9894 H 1 UNK 0.0308 35 H16 -5.1774 0.4895 2.4339 H 1 UNK 0.0308 @BOND 1 1 9 ar 2 1 12 ar 3 2 14 1 4 3 7 ar 5 3 8 1 6 3 12 ar 7 4 15 ar 8 4 17 ar 9 5 16 ar 10 5 17 ar 11 6 15 1 12 7 9 ar 13 7 13 1 14 8 11 1 15 9 10 1 16 10 14 1 17 11 15 ar 18 11 16 ar 19 17 18 1 20 2 19 1 21 6 20 1 22 6 21 1 23 8 22 1 24 8 23 1 25 10 24 1 26 10 25 1 27 12 26 1 28 13 27 1 29 13 28 1 30 13 29 1 31 14 30 1 32 14 31 1 33 16 32 1 34 18 33 1 35 18 34 1 36 18 35 1