@MOLECULE FDBF07552 33 34 0 0 0 SMALL GASTEIGER @ATOM 1 C1 0.8800 -0.5530 1.2200 C.3 1 FRG1 -0.0448 2 N1 0.8590 -2.0210 1.1550 N.4 1 FRG1 0.2267 3 C1 0.7350 -4.0840 2.4680 C.3 1 FRG1 0.1247 4 O2 -0.6810 -4.2210 2.2300 O.3 1 FRG1 -0.3379 5 C3 -1.1580 -5.2620 3.0920 C.3 1 FRG1 0.1708 6 O4 -0.0520 -5.7820 3.8490 O.3 1 FRG1 -0.3458 7 C5 0.9160 -4.7050 3.8750 C.3 1 FRG1 0.0822 8 C8 -2.2070 -4.6950 4.0500 C.3 1 FRG1 0.0014 9 C9 -3.3890 -4.1480 3.2470 C.3 1 FRG1 -0.0482 10 C10 -4.0070 -5.2760 2.4170 C.3 1 FRG1 -0.0527 11 C11 -2.9560 -5.8340 1.4550 C.3 1 FRG1 -0.0482 12 C12 -1.7730 -6.3840 2.2540 C.3 1 FRG1 0.0014 13 C1 1.1420 -2.6100 2.4710 C.3 1 FRG1 -0.0047 14 H 0.6715 -0.1501 0.2510 H 1 FRG1 0.0777 15 H 1.8457 -0.2241 1.5428 H 1 FRG1 0.0777 16 H 0.1382 -0.2160 1.9136 H 1 FRG1 0.0777 17 H 1.5653 -2.3356 0.4898 H 1 FRG1 0.2012 18 H -0.0698 -2.3201 0.8579 H 1 FRG1 0.2012 19 H 1.3368 -4.5543 1.7186 H 1 FRG1 0.0674 20 H 0.6911 -3.9972 4.6453 H 1 FRG1 0.0589 21 H 1.9157 -5.0252 4.0825 H 1 FRG1 0.0589 22 H -1.7728 -3.9060 4.6278 H 1 FRG1 0.0317 23 H -2.5485 -5.4700 4.7040 H 1 FRG1 0.0317 24 H -4.1242 -3.7544 3.9175 H 1 FRG1 0.0267 25 H -3.0485 -3.3707 2.5953 H 1 FRG1 0.0267 26 H -4.3440 -6.0551 3.0684 H 1 FRG1 0.0265 27 H -4.8365 -4.8954 1.8584 H 1 FRG1 0.0265 28 H -3.3883 -6.6198 0.8715 H 1 FRG1 0.0267 29 H -2.6161 -5.0535 0.8068 H 1 FRG1 0.0267 30 H -1.0368 -6.7708 1.5807 H 1 FRG1 0.0317 31 H -2.1120 -7.1668 2.8999 H 1 FRG1 0.0317 32 H 0.5867 -2.0882 3.2222 H 1 FRG1 0.0840 33 H 2.1882 -2.5293 2.6803 H 1 FRG1 0.0840 @BOND 1 2 1 1 2 2 13 1 3 11 12 1 4 11 10 1 5 4 3 1 6 4 5 1 7 12 5 1 8 10 9 1 9 3 13 1 10 3 7 1 11 5 6 1 12 5 8 1 13 9 8 1 14 6 7 1 15 1 14 1 16 1 15 1 17 1 16 1 18 2 17 1 19 2 18 1 20 3 19 1 21 7 20 1 22 7 21 1 23 8 22 1 24 8 23 1 25 9 24 1 26 9 25 1 27 10 26 1 28 10 27 1 29 11 28 1 30 11 29 1 31 12 30 1 32 12 31 1 33 13 32 1 34 13 33 1