@MOLECULE FDBD00168 40 40 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.6658 -0.1341 1.4612 O.2 1 UNK -0.2696 2 N 3.0943 -0.0513 0.1541 N.4 1 UNK 0.2414 3 N1 -0.3988 -0.3956 -0.6150 N.am 1 UNK -0.2807 4 C 1.9647 -0.7259 -0.4841 C.3 1 UNK 0.0463 5 C1 2.9035 1.3985 0.1306 C.3 1 UNK -0.0343 6 C2 4.3466 -0.4130 -0.5090 C.3 1 UNK -0.0343 7 C3 -1.7556 -0.1301 -0.3123 C.ar 1 UNK 0.0394 8 C4 0.6855 -0.3834 0.2600 C.2 1 UNK 0.2624 9 C5 -2.5858 -1.1738 0.0688 C.ar 1 UNK -0.0290 10 C6 -2.2323 1.1693 -0.4028 C.ar 1 UNK -0.0290 11 C7 4.0688 2.1164 0.7901 C.3 1 UNK -0.0245 12 C8 4.5916 -1.9108 -0.4404 C.3 1 UNK -0.0245 13 C9 -3.9233 -0.9124 0.3660 C.ar 1 UNK -0.0571 14 C10 -3.5698 1.4306 -0.1054 C.ar 1 UNK -0.0571 15 C11 -2.0884 -2.5795 0.1705 C.3 1 UNK -0.0379 16 C12 -1.3515 2.3053 -0.8116 C.3 1 UNK -0.0379 17 C13 -4.4152 0.3898 0.2790 C.ar 1 UNK -0.0611 18 H 3.1444 -0.3548 1.1266 H 1 UNK 0.2038 19 H1 -0.1976 -0.6145 -1.5535 H 1 UNK 0.1550 20 H2 2.1201 -1.7842 -0.4582 H 1 UNK 0.0913 21 H3 1.8838 -0.4025 -1.5009 H 1 UNK 0.0913 22 H4 2.0026 1.6406 0.6547 H 1 UNK 0.0812 23 H5 2.8433 1.7160 -0.8894 H 1 UNK 0.0812 24 H6 5.1559 0.0955 -0.0279 H 1 UNK 0.0812 25 H7 4.2801 -0.1272 -1.5380 H 1 UNK 0.0812 26 H8 4.1438 1.8101 1.8126 H 1 UNK 0.0281 27 H9 3.9081 3.1733 0.7452 H 1 UNK 0.0281 28 H10 4.9752 1.8713 0.2770 H 1 UNK 0.0281 29 H11 4.6609 -2.2144 0.5833 H 1 UNK 0.0281 30 H12 5.5054 -2.1462 -0.9449 H 1 UNK 0.0281 31 H13 3.7811 -2.4267 -0.9113 H 1 UNK 0.0281 32 H14 -4.5488 -1.6824 0.6502 H 1 UNK 0.0621 33 H15 -3.9339 2.3941 -0.1698 H 1 UNK 0.0621 34 H16 -1.0506 -2.6102 -0.0880 H 1 UNK 0.0278 35 H17 -2.6417 -3.2030 -0.5003 H 1 UNK 0.0278 36 H18 -2.2169 -2.9317 1.1727 H 1 UNK 0.0278 37 H19 -0.3642 1.9401 -1.0031 H 1 UNK 0.0278 38 H20 -1.3173 3.0307 -0.0258 H 1 UNK 0.0278 39 H21 -1.7424 2.7584 -1.6986 H 1 UNK 0.0278 40 H22 -5.4047 0.5833 0.4990 H 1 UNK 0.0618 @BOND 1 1 8 2 2 2 4 1 3 2 5 1 4 2 6 1 5 3 7 1 6 3 8 am 7 4 8 1 8 5 11 1 9 6 12 1 10 7 9 ar 11 7 10 ar 12 9 13 ar 13 9 15 1 14 10 14 ar 15 10 16 1 16 13 17 ar 17 14 17 ar 18 2 18 1 19 3 19 1 20 4 20 1 21 4 21 1 22 5 22 1 23 5 23 1 24 6 24 1 25 6 25 1 26 11 26 1 27 11 27 1 28 11 28 1 29 12 29 1 30 12 30 1 31 12 31 1 32 13 32 1 33 14 33 1 34 15 34 1 35 15 35 1 36 15 36 1 37 16 37 1 38 16 38 1 39 16 39 1 40 17 40 1