@MOLECULE FDBF00515 16 15 0 0 0 SMALL GASTEIGER @ATOM 1 C1 -1.3550 -0.4770 -4.3630 C.3 1 FRG1 0.0102 2 C5 -1.6550 -1.9570 -4.5020 C.3 1 FRG1 -0.0495 3 O1 -2.6270 1.7850 0.3430 O.2 1 FRG1 -0.2791 4 C2 -2.0930 0.9240 -0.3630 C.2 1 FRG1 0.2073 5 N3 -2.7720 -0.1880 -0.9180 N.am 1 FRG1 -0.2428 6 C4 -2.4280 -0.8310 -2.1470 C.2 1 FRG1 0.3057 7 O5 -2.6190 -2.0270 -2.3780 O.2 1 FRG1 -0.2524 8 N6 -1.8090 0.0050 -3.0790 N.am 1 FRG1 -0.2994 9 H -1.8575 0.0601 -5.1401 H 1 FRG1 0.0460 10 H -0.2985 -0.3260 -4.4393 H 1 FRG1 0.0460 11 H -2.7105 -2.1156 -4.4267 H 1 FRG1 0.0245 12 H -1.1568 -2.4965 -3.7238 H 1 FRG1 0.0245 13 H -1.3093 -2.3032 -5.4536 H 1 FRG1 0.0245 14 H -1.0850 1.0212 -0.5618 H 1 FRG1 0.1256 15 H -3.5410 -0.5460 -0.4182 H 1 FRG1 0.1588 16 H -1.6777 0.9543 -2.8535 H 1 FRG1 0.1502 @BOND 1 2 1 1 2 1 8 1 3 8 6 am 4 7 6 2 5 6 5 am 6 5 4 am 7 4 3 2 8 1 9 1 9 1 10 1 10 2 11 1 11 2 12 1 12 2 13 1 13 4 14 1 14 5 15 1 15 8 16 1