@MOLECULE FDBF00184 22 22 0 0 0 SMALL GASTEIGER @ATOM 1 C1 -0.5350 -0.7250 -1.2340 C.ar 1 FRG1 -0.0303 2 C2 -0.1980 -1.1230 0.0600 C.ar 1 FRG1 -0.0571 3 C3 1.1370 -1.3550 0.3920 C.ar 1 FRG1 -0.0615 4 C4 2.1340 -1.1890 -0.5690 C.ar 1 FRG1 -0.0617 5 C5 1.7960 -0.7910 -1.8630 C.ar 1 FRG1 -0.0615 6 C6 0.4620 -0.5580 -2.1950 C.ar 1 FRG1 -0.0571 7 C1 -4.2560 -1.5360 -0.1130 C.3 1 FRG1 0.0122 8 C1 -1.9720 -0.4750 -1.5930 C.3 1 FRG1 0.0368 9 O1 -4.3160 0.5690 1.0340 O.2 1 FRG1 -0.2761 10 C2 -3.7600 -0.1260 0.1780 C.2 1 FRG1 0.2102 11 N3 -2.6620 0.3090 -0.5710 N.am 1 FRG1 -0.3114 12 H -0.9358 -1.2457 0.7711 H 1 FRG1 0.0621 13 H 1.3869 -1.6495 1.3490 H 1 FRG1 0.0618 14 H 3.1215 -1.3605 -0.3231 H 1 FRG1 0.0618 15 H 2.5336 -0.6691 -2.5745 H 1 FRG1 0.0618 16 H 0.2124 -0.2620 -3.1516 H 1 FRG1 0.0621 17 H -3.6520 -1.9756 -0.8790 H 1 FRG1 0.0322 18 H -5.2738 -1.4955 -0.4406 H 1 FRG1 0.0322 19 H -4.1907 -2.1277 0.7761 H 1 FRG1 0.0322 20 H -2.4699 -1.4159 -1.7016 H 1 FRG1 0.0512 21 H -1.9929 0.0811 -2.5069 H 1 FRG1 0.0512 22 H -2.3265 1.2177 -0.3953 H 1 FRG1 0.1490 @BOND 1 6 5 ar 2 6 1 ar 3 5 4 ar 4 8 1 1 5 8 11 1 6 1 2 ar 7 11 10 am 8 4 3 ar 9 7 10 1 10 2 3 ar 11 10 9 2 12 2 12 1 13 3 13 1 14 4 14 1 15 5 15 1 16 6 16 1 17 7 17 1 18 7 18 1 19 7 19 1 20 8 20 1 21 8 21 1 22 11 22 1