@MOLECULE ***** 25 27 0 0 0 SMALL GASTEIGER @ATOM 1 O -3.3250 -1.4490 -0.1330 O.2 1 UNL1 -0.2919 2 C -2.6010 -0.4920 0.0520 C.2 1 UNL1 0.1679 3 C -3.1590 0.8960 0.3140 C.3 1 UNL1 0.0260 4 C -2.2530 1.8850 -0.4330 C.3 1 UNL1 0.0162 5 N -0.8910 1.8010 0.0990 N.pl3 1 UNL1 -0.3423 6 C -0.3500 0.5470 0.0500 C.ar 1 UNL1 0.0485 7 C -1.1370 -0.6140 0.0410 C.ar 1 UNL1 0.0569 8 C -0.5250 -1.8780 0.0160 C.ar 1 UNL1 0.0405 9 N 0.7780 -2.0010 -0.0030 N.ar 1 UNL1 -0.2542 10 C 1.5920 -0.9340 0.0010 C.ar 1 UNL1 0.0728 11 C 1.0580 0.3790 0.0200 C.ar 1 UNL1 0.0219 12 C 1.9200 1.4830 0.0260 C.ar 1 UNL1 -0.0508 13 C 3.2690 1.2850 -0.0030 C.ar 1 UNL1 -0.0610 14 C 3.7990 -0.0010 -0.0390 C.ar 1 UNL1 -0.0597 15 C 2.9860 -1.0990 -0.0230 C.ar 1 UNL1 -0.0357 16 H -4.1790 0.9660 -0.0640 H 1 UNL1 0.0360 17 H -3.1420 1.1090 1.3830 H 1 UNL1 0.0360 18 H -2.2430 1.6380 -1.4950 H 1 UNL1 0.0465 19 H -2.6330 2.8980 -0.3000 H 1 UNL1 0.0465 20 H -0.8440 2.1790 1.0330 H 1 UNL1 0.1461 21 H -1.1400 -2.7650 0.0120 H 1 UNL1 0.0837 22 H 1.5180 2.4850 0.0540 H 1 UNL1 0.0625 23 H 3.9340 2.1360 0.0020 H 1 UNL1 0.0618 24 H 4.8700 -0.1340 -0.0630 H 1 UNL1 0.0618 25 H 3.4130 -2.0910 -0.0470 H 1 UNL1 0.0639 @BOND 1 1 2 2 2 8 9 ar 3 8 7 ar 4 9 10 ar 5 2 7 1 6 2 3 1 7 7 6 ar 8 3 4 1 9 10 15 ar 10 10 11 ar 11 15 14 ar 12 6 11 ar 13 6 5 1 14 4 5 1 15 11 12 ar 16 14 13 ar 17 12 13 ar 18 3 16 1 19 3 17 1 20 4 18 1 21 4 19 1 22 5 20 1 23 8 21 1 24 12 22 1 25 13 23 1 26 14 24 1 27 15 25 1