@MOLECULE FDBF01111 28 29 0 0 0 SMALL GASTEIGER @ATOM 1 N1 -1.6800 0.8460 0.0770 N.ar 1 FRG1 -0.3472 2 C2 -2.5620 0.0600 0.7710 C.ar 1 FRG1 0.0049 3 C3 -1.8350 -0.7330 1.6310 C.ar 1 FRG1 -0.0435 4 C4 -0.4680 -0.4130 1.4480 C.ar 1 FRG1 -0.0330 5 C5 -0.4390 0.5460 0.4980 C.ar 1 FRG1 0.0895 6 C8 -2.0420 1.8200 -0.9310 C.3 1 FRG1 0.0120 7 O1 0.7490 2.3780 -0.4370 O.2 1 FRG1 -0.2851 8 C2 0.7730 1.2020 -0.0350 C.2 1 FRG1 0.2093 9 C1 2.0450 0.5000 -0.0920 C.ar 1 FRG1 0.0238 10 C2 2.0710 -0.8850 -0.2570 C.ar 1 FRG1 -0.0506 11 C3 3.2920 -1.5580 -0.3100 C.ar 1 FRG1 -0.0582 12 C4 4.4860 -0.8470 -0.1990 C.ar 1 FRG1 -0.0504 13 C5 4.4600 0.5380 -0.0350 C.ar 1 FRG1 -0.0582 14 C6 3.2400 1.2120 0.0190 C.ar 1 FRG1 -0.0506 15 C12 5.7910 -1.5660 -0.2580 C.3 1 FRG1 -0.0397 16 H -3.5888 0.0618 0.6677 H 1 FRG1 0.0809 17 H -2.2164 -1.4317 2.2878 H 1 FRG1 0.0633 18 H 0.3395 -0.8272 1.9393 H 1 FRG1 0.0640 19 H -1.1571 2.2886 -1.3082 H 1 FRG1 0.0456 20 H -2.6810 2.5609 -0.4978 H 1 FRG1 0.0456 21 H -2.5555 1.3304 -1.7320 H 1 FRG1 0.0456 22 H 1.1873 -1.4116 -0.3398 H 1 FRG1 0.0625 23 H 3.3113 -2.5826 -0.4314 H 1 FRG1 0.0620 24 H 5.3440 1.0643 0.0464 H 1 FRG1 0.0620 25 H 3.2211 2.2366 0.1410 H 1 FRG1 0.0625 26 H 5.6155 -2.6137 -0.3860 H 1 FRG1 0.0278 27 H 6.3294 -1.4031 0.6522 H 1 FRG1 0.0278 28 H 6.3645 -1.1971 -1.0825 H 1 FRG1 0.0278 @BOND 1 6 1 1 2 7 8 2 3 11 10 ar 4 11 12 ar 5 15 12 1 6 10 9 ar 7 12 13 ar 8 9 8 1 9 9 14 ar 10 8 5 1 11 13 14 ar 12 1 5 ar 13 1 2 ar 14 5 4 ar 15 2 3 ar 16 4 3 ar 17 2 16 1 18 3 17 1 19 4 18 1 20 6 19 1 21 6 20 1 22 6 21 1 23 10 22 1 24 11 23 1 25 13 24 1 26 14 25 1 27 15 26 1 28 15 27 1 29 15 28 1