@MOLECULE FDBF03871 35 35 0 0 0 SMALL GASTEIGER @ATOM 1 C1 3.1800 -2.8090 0.5740 C.3 1 FRG1 -0.0081 2 C4 3.6220 -4.2150 0.0990 C.3 1 FRG1 -0.0574 3 C8 3.8590 -2.5600 1.9410 C.3 1 FRG1 -0.0574 4 O1 -0.1980 4.4710 0.0360 O.2 1 FRG1 -0.2973 5 C2 0.7510 3.7640 -0.2840 C.2 1 FRG1 0.1365 6 C3 0.7770 2.2550 -0.1530 C.3 1 FRG1 0.0145 7 C4 2.2810 1.9710 -0.2840 C.3 1 FRG1 0.0102 8 C5 2.7710 3.0350 -1.2750 C.3 1 FRG1 0.0685 9 C6 2.0290 4.3070 -0.8690 C.3 1 FRG1 0.0324 10 O12 4.1720 3.2140 -1.1460 O.3 1 FRG1 -0.3908 11 C1 1.6330 -2.8410 0.7650 C.3 1 FRG1 -0.0574 12 C1 3.6440 -1.7170 -0.4470 C.3 1 FRG1 0.0782 13 O3 5.0510 -1.8340 -0.6790 O.3 1 FRG1 -0.3872 14 C1 2.5650 0.5760 -0.7410 C.2 1 FRG1 -0.0796 15 C2 3.3080 -0.2980 -0.0430 C.2 1 FRG1 -0.0590 16 H 3.1728 -4.4290 -0.8483 H 1 FRG1 0.0236 17 H 3.3113 -4.9473 0.8147 H 1 FRG1 0.0236 18 H 4.6873 -4.2403 0.0024 H 1 FRG1 0.0236 19 H 4.9211 -2.5375 1.8129 H 1 FRG1 0.0236 20 H 3.5979 -3.3468 2.6175 H 1 FRG1 0.0236 21 H 3.5278 -1.6234 2.3384 H 1 FRG1 0.0236 22 H 0.2192 1.7837 -0.9351 H 1 FRG1 0.0348 23 H 0.3367 1.8845 0.7491 H 1 FRG1 0.0348 24 H 2.7903 2.0303 0.6551 H 1 FRG1 0.0372 25 H 2.5853 2.7653 -2.2937 H 1 FRG1 0.0603 26 H 1.8328 4.9282 -1.7178 H 1 FRG1 0.0367 27 H 2.5801 4.9254 -0.1917 H 1 FRG1 0.0367 28 H 4.3836 3.4607 -0.2321 H 1 FRG1 0.2098 29 H 1.1605 -3.0132 -0.1795 H 1 FRG1 0.0236 30 H 1.3033 -1.9042 1.1632 H 1 FRG1 0.0236 31 H 1.3734 -3.6276 1.4423 H 1 FRG1 0.0236 32 H 3.0928 -1.9048 -1.3447 H 1 FRG1 0.0643 33 H 5.5303 -1.6602 0.1462 H 1 FRG1 0.2102 34 H 2.1682 0.2679 -1.6425 H 1 FRG1 0.0573 35 H 3.6876 0.0307 0.8586 H 1 FRG1 0.0595 @BOND 1 8 10 1 2 8 9 1 3 8 7 1 4 9 5 1 5 14 7 1 6 14 15 2 7 13 12 1 8 12 15 1 9 12 1 1 10 5 6 1 11 5 4 2 12 7 6 1 13 2 1 1 14 1 11 1 15 1 3 1 16 2 16 1 17 2 17 1 18 2 18 1 19 3 19 1 20 3 20 1 21 3 21 1 22 6 22 1 23 6 23 1 24 7 24 1 25 8 25 1 26 9 26 1 27 9 27 1 28 10 28 1 29 11 29 1 30 11 30 1 31 11 31 1 32 12 32 1 33 13 33 1 34 14 34 1 35 15 35 1