@MOLECULE FDBF01207 31 33 0 0 0 SMALL GASTEIGER @ATOM 1 C1 3.7860 -0.5760 -0.7300 C.ar 1 FRG1 0.0335 2 C2 4.3590 -0.1860 0.4810 C.ar 1 FRG1 -0.0251 3 C3 5.6540 -0.5920 0.8020 C.ar 1 FRG1 0.0264 4 C4 6.3770 -1.3880 -0.0880 C.ar 1 FRG1 -0.0462 5 C5 5.8030 -1.7780 -1.2980 C.ar 1 FRG1 -0.0589 6 C6 4.5080 -1.3720 -1.6190 C.ar 1 FRG1 -0.0404 7 N1 2.4830 -0.1680 -1.0540 N.pl3 1 FRG1 -0.2988 8 N1 0.3260 3.2230 -0.0630 N.ar 1 FRG1 -0.2352 9 C2 -0.3340 2.0710 -0.2760 C.ar 1 FRG1 0.0795 10 C3 0.3440 0.8890 -0.6150 C.ar 1 FRG1 0.0407 11 C4 -0.3570 -0.3090 -0.8360 C.ar 1 FRG1 -0.0458 12 C5 -1.7430 -0.3360 -0.7210 C.ar 1 FRG1 -0.0194 13 C6 -2.4260 0.8280 -0.3860 C.ar 1 FRG1 0.1189 14 C7 -1.7220 2.0160 -0.1670 C.ar 1 FRG1 0.0059 15 C10 1.7300 0.9840 -0.7150 C.ar 1 FRG1 0.1339 16 N11 2.4220 2.1200 -0.5080 N.ar 1 FRG1 -0.2200 17 C12 1.6680 3.1850 -0.1900 C.ar 1 FRG1 0.1187 18 C1 6.2420 -0.1930 2.0410 C.1 1 FRG1 -0.0696 19 C2 6.7360 0.1420 3.0830 C.1 1 FRG1 -0.1139 20 O1 -3.7830 0.8250 -0.2670 O.3 1 FRG1 -0.5067 21 H 3.8246 0.4027 1.1389 H 1 FRG1 0.0648 22 H 7.3356 -1.6878 0.1491 H 1 FRG1 0.0630 23 H 6.3368 -2.3672 -1.9559 H 1 FRG1 0.0619 24 H 4.0839 -1.6606 -2.5145 H 1 FRG1 0.0636 25 H 1.9984 -0.8048 -1.6274 H 1 FRG1 0.1536 26 H 0.1568 -1.1690 -1.0837 H 1 FRG1 0.0626 27 H -2.2608 -1.2138 -0.8832 H 1 FRG1 0.0654 28 H -2.2424 2.8719 0.0811 H 1 FRG1 0.0675 29 H 2.1706 4.0711 -0.0248 H 1 FRG1 0.1048 30 H 7.1449 0.4193 3.9455 H 1 FRG1 0.1232 31 H -4.2642 0.0341 -0.4117 H 1 FRG1 0.2921 @BOND 1 6 5 ar 2 6 1 ar 3 5 4 ar 4 7 1 1 5 7 15 1 6 11 12 ar 7 11 10 ar 8 1 2 ar 9 12 13 ar 10 15 10 ar 11 15 16 ar 12 10 9 ar 13 16 17 ar 14 13 20 1 15 13 14 ar 16 9 14 ar 17 9 8 ar 18 17 8 ar 19 4 3 ar 20 2 3 ar 21 3 18 1 22 18 19 3 23 2 21 1 24 4 22 1 25 5 23 1 26 6 24 1 27 7 25 1 28 11 26 1 29 12 27 1 30 14 28 1 31 17 29 1 32 19 30 1 33 20 31 1