@MOLECULE FDBF00050 21 21 0 0 0 SMALL GASTEIGER @ATOM 1 C1 -2.8050 1.9680 -0.5230 C.3 1 FRG1 -0.0024 2 O1 4.2380 1.9580 1.7560 O.2 1 FRG1 -0.2704 3 C2 3.5840 1.4830 0.8120 C.2 1 FRG1 0.2415 4 N3 4.1840 0.7900 -0.2460 N.am 1 FRG1 -0.3253 5 N1 -2.0260 1.9780 0.6860 N.pl3 1 FRG1 -0.3469 6 C1 -0.6430 1.8550 0.7170 C.ar 1 FRG1 0.0269 7 C2 0.0710 1.7120 -0.4720 C.ar 1 FRG1 -0.0401 8 C3 1.4600 1.5900 -0.4410 C.ar 1 FRG1 -0.0479 9 C4 2.1350 1.6100 0.7790 C.ar 1 FRG1 0.0366 10 C5 1.4210 1.7530 1.9690 C.ar 1 FRG1 -0.0479 11 C6 0.0320 1.8760 1.9380 C.ar 1 FRG1 -0.0401 12 H -3.8413 2.0779 -0.2805 H 1 FRG1 0.0425 13 H -2.6551 1.0412 -1.0362 H 1 FRG1 0.0425 14 H -2.4981 2.7775 -1.1518 H 1 FRG1 0.0425 15 H 3.6297 0.4290 -0.9752 H 1 FRG1 0.1453 16 H 5.1602 0.6636 -0.2609 H 1 FRG1 0.1453 17 H -2.5013 2.0780 1.5423 H 1 FRG1 0.1457 18 H -0.4283 1.6964 -1.3750 H 1 FRG1 0.0636 19 H 1.9884 1.4849 -1.3212 H 1 FRG1 0.0626 20 H 1.9204 1.7678 2.8720 H 1 FRG1 0.0626 21 H -0.4964 1.9825 2.8180 H 1 FRG1 0.0636 @BOND 1 1 5 1 2 7 8 ar 3 7 6 ar 4 8 9 ar 5 4 3 am 6 5 6 1 7 6 11 ar 8 9 3 1 9 9 10 ar 10 3 2 2 11 11 10 ar 12 1 12 1 13 1 13 1 14 1 14 1 15 4 15 1 16 4 16 1 17 5 17 1 18 7 18 1 19 8 19 1 20 10 20 1 21 11 21 1