@MOLECULE FDBF05631 28 28 0 0 0 SMALL GASTEIGER @ATOM 1 C1 1.3250 0.0980 0.9830 C.ar 1 FRG1 -0.0262 2 C2 0.9040 0.3090 2.2890 C.ar 1 FRG1 0.0395 3 C3 1.7950 0.1330 3.3400 C.ar 1 FRG1 -0.0262 4 C4 3.0990 -0.2410 3.0820 C.ar 1 FRG1 -0.0568 5 C5 3.5170 -0.4450 1.7790 C.ar 1 FRG1 -0.0611 6 C6 2.6310 -0.2760 0.7310 C.ar 1 FRG1 -0.0568 7 C1 0.2270 1.7710 -0.4810 C.3 1 FRG1 -0.0612 8 C5 0.3600 0.2810 -0.1600 C.3 1 FRG1 -0.0288 9 N1 -0.4180 0.6880 2.5470 N.am 1 FRG1 -0.2876 10 C2 -0.7130 1.9810 2.7870 C.2 1 FRG1 0.2041 11 O3 -1.8470 2.3000 3.0760 O.2 1 FRG1 -0.2792 12 C1 1.3410 0.3560 4.7590 C.3 1 FRG1 -0.0288 13 C5 0.8660 -0.9700 5.3570 C.3 1 FRG1 -0.0612 14 H 3.7625 -0.3685 3.8621 H 1 FRG1 0.0621 15 H 4.4922 -0.7239 1.5888 H 1 FRG1 0.0618 16 H 2.9454 -0.4293 -0.2399 H 1 FRG1 0.0621 17 H -0.4581 1.9012 -1.2925 H 1 FRG1 0.0233 18 H 1.1838 2.1635 -0.7555 H 1 FRG1 0.0233 19 H -0.1377 2.2903 0.3805 H 1 FRG1 0.0233 20 H 0.7248 -0.2383 -1.0215 H 1 FRG1 0.0311 21 H -0.5968 -0.1117 0.1144 H 1 FRG1 0.0311 22 H -1.1323 0.0105 2.5532 H 1 FRG1 0.1546 23 H 0.0255 2.6992 2.7249 H 1 FRG1 0.1255 24 H 0.5358 1.0606 4.7693 H 1 FRG1 0.0311 25 H 2.1559 0.7370 5.3385 H 1 FRG1 0.0311 26 H 0.0511 -1.3510 4.7776 H 1 FRG1 0.0233 27 H 0.5436 -0.8116 6.3649 H 1 FRG1 0.0233 28 H 1.6711 -1.6747 5.3467 H 1 FRG1 0.0233 @BOND 1 7 8 1 2 8 1 1 3 6 1 ar 4 6 5 ar 5 1 2 ar 6 5 4 ar 7 2 9 1 8 2 3 ar 9 9 10 am 10 10 11 2 11 4 3 ar 12 3 12 1 13 12 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 9 22 1 23 10 23 1 24 12 24 1 25 12 25 1 26 13 26 1 27 13 27 1 28 13 28 1