@MOLECULE FDBF00187 21 20 0 0 0 SMALL GASTEIGER @ATOM 1 C1 -5.4570 -1.9270 0.7500 C.3 1 FRG1 -0.0450 2 C1 -4.2560 -1.5360 -0.1130 C.3 1 FRG1 0.0239 3 C1 -1.9720 -0.4750 -1.5930 C.3 1 FRG1 0.0001 4 O1 -4.3160 0.5690 1.0340 O.2 1 FRG1 -0.2758 5 C2 -3.7600 -0.1260 0.1780 C.2 1 FRG1 0.2128 6 N3 -2.6620 0.3090 -0.5710 N.am 1 FRG1 -0.3184 7 C1 -5.9070 -3.3580 0.4610 C.3 1 FRG1 -0.0555 8 C5 -7.0770 -3.7640 1.3430 C.3 1 FRG1 -0.0653 9 H -6.2667 -1.2587 0.5434 H 1 FRG1 0.0270 10 H -5.1677 -1.8655 1.7783 H 1 FRG1 0.0270 11 H -3.4596 -2.2252 0.0757 H 1 FRG1 0.0358 12 H -4.5689 -1.5648 -1.1358 H 1 FRG1 0.0358 13 H -1.1704 0.1021 -2.0045 H 1 FRG1 0.0426 14 H -2.6609 -0.7333 -2.3699 H 1 FRG1 0.0426 15 H -1.5794 -1.3678 -1.1530 H 1 FRG1 0.0426 16 H -2.3265 1.2177 -0.3953 H 1 FRG1 0.1484 17 H -5.0884 -4.0229 0.6417 H 1 FRG1 0.0263 18 H -6.2227 -3.4105 -0.5600 H 1 FRG1 0.0263 19 H -6.7818 -3.7182 2.3705 H 1 FRG1 0.0230 20 H -7.3757 -4.7628 1.1019 H 1 FRG1 0.0230 21 H -7.8969 -3.0967 1.1774 H 1 FRG1 0.0230 @BOND 1 3 6 1 2 6 5 am 3 2 5 1 4 2 1 1 5 5 4 2 6 7 1 1 7 7 8 1 8 1 9 1 9 1 10 1 10 2 11 1 11 2 12 1 12 3 13 1 13 3 14 1 14 3 15 1 15 6 16 1 16 7 17 1 17 7 18 1 18 8 19 1 19 8 20 1 20 8 21 1