@MOLECULE CG 31 32 0 0 0 SMALL GASTEIGER @ATOM 1 C -0.4890 -1.9810 0.0010 C.ar 1 UNL1 -0.0525 2 C -0.2880 -0.5920 -0.0050 C.ar 1 UNL1 0.0032 3 C -1.3880 0.2580 0.0010 C.ar 1 UNL1 -0.0232 4 C -2.6770 -0.2750 0.0000 C.ar 1 UNL1 0.0685 5 C -3.8510 0.6280 0.0000 C.2 1 UNL1 0.3084 6 N -5.1250 0.1010 0.0000 N.2 1 UNL1 -0.0994 7 N -3.6800 1.9190 0.0010 N.pl3 1 UNL1 -0.2466 8 C -2.8610 -1.6570 0.0000 C.ar 1 UNL1 -0.0466 9 C -1.7660 -2.5000 0.0010 C.ar 1 UNL1 -0.0603 10 C -0.9220 1.6940 0.0000 C.3 1 UNL1 -0.0207 11 C 0.6130 1.6500 0.0000 C.3 1 UNL1 -0.0029 12 C 0.9680 0.1830 0.0010 C.2 1 UNL1 0.0839 13 N 2.1690 -0.3100 0.0010 N.2 1 UNL1 -0.1158 14 N 3.2780 0.5450 0.0000 N.pl3 1 UNL1 -0.1547 15 C 4.5510 0.0220 0.0000 C.cat 1 UNL1 0.3997 16 N 4.7240 -1.2700 0.0000 N.pl3 1 UNL1 -0.1280 17 N 5.6400 0.8620 0.0000 N.pl3 1 UNL1 -0.2876 18 H 0.3610 -2.6470 0.0020 H 1 UNL1 0.0624 19 H -5.2520 -0.8600 -0.0010 H 1 UNL1 0.3633 20 H 26.5320 -1.6340 -43.5470 H 1 UNL1 0.2884 21 H -4.4490 2.5100 0.0010 H 1 UNL1 0.2884 22 H -3.8590 -2.0690 0.0000 H 1 UNL1 0.0626 23 H -1.9110 -3.5700 0.0010 H 1 UNL1 0.0618 24 H -1.2810 2.2050 0.8930 H 1 UNL1 0.0317 25 H -1.2810 2.2040 -0.8940 H 1 UNL1 0.0317 26 H 1.0050 2.1340 0.8940 H 1 UNL1 0.0333 27 H 1.0050 2.1330 -0.8950 H 1 UNL1 0.0333 28 H 3.1490 1.5070 0.0000 H 1 UNL1 0.2922 29 H 5.6220 -1.6390 0.0000 H 1 UNL1 0.3062 30 H 5.5110 1.8240 -0.0010 H 1 UNL1 0.2547 31 H 6.5370 0.4940 0.0030 H 1 UNL1 0.2547 @BOND 1 1 2 ar 2 1 9 ar 3 1 18 1 4 2 3 ar 5 2 12 1 6 3 4 ar 7 3 10 1 8 4 5 1 9 4 8 ar 10 5 6 2 11 5 7 1 12 6 19 1 13 7 20 1 14 7 21 1 15 8 9 ar 16 8 22 1 17 9 23 1 18 10 11 1 19 10 24 1 20 10 25 1 21 11 12 1 22 11 26 1 23 11 27 1 24 12 13 2 25 13 14 1 26 14 15 1 27 14 28 1 28 15 16 2 29 15 17 1 30 16 29 1 31 17 30 1 32 17 31 1