@MOLECULE ***** 62 65 0 0 0 SMALL GASTEIGER @ATOM 1 C -1.3400 -3.0220 -0.4380 C.ar 1 UNL1 -0.0605 2 C -0.0070 -2.7940 -0.1560 C.ar 1 UNL1 -0.0540 3 C 0.4050 -1.5510 0.3250 C.ar 1 UNL1 -0.0172 4 C -5.1020 1.1050 0.2680 C.ar 1 UNL1 0.0374 5 C -6.1780 1.1660 -0.6090 C.ar 1 UNL1 -0.0155 6 C -7.0990 2.1900 -0.5000 C.ar 1 UNL1 -0.0563 7 C -6.9500 3.1530 0.4810 C.ar 1 UNL1 -0.0614 8 C -5.8800 3.0950 1.3560 C.ar 1 UNL1 -0.0600 9 C -4.9560 2.0740 1.2520 C.ar 1 UNL1 -0.0402 10 C -6.3400 0.1170 -1.6780 C.3 1 UNL1 0.0716 11 C -7.0600 -1.0770 -1.1060 C.2 1 UNL1 0.3091 12 C 2.7740 -2.3220 0.4320 C.ar 1 UNL1 -0.0537 13 C 4.1060 -2.0890 0.7100 C.ar 1 UNL1 -0.0568 14 C 4.5110 -0.8540 1.1810 C.ar 1 UNL1 -0.0333 15 C 3.5860 0.1550 1.3770 C.ar 1 UNL1 -0.0568 16 C 2.2510 -0.0660 1.1020 C.ar 1 UNL1 -0.0537 17 C 5.9670 -0.6060 1.4820 C.3 1 UNL1 0.0241 18 C 8.0940 -0.0630 0.4590 C.3 1 UNL1 0.0120 19 C 8.7570 0.4000 -0.8400 C.3 1 UNL1 0.0114 20 C 6.7880 1.7000 -1.3810 C.3 1 UNL1 0.0114 21 C -0.5290 -0.5390 0.5210 C.ar 1 UNL1 -0.0419 22 C -1.8730 -0.7740 0.2350 C.ar 1 UNL1 0.0376 23 C -2.2720 -2.0210 -0.2510 C.ar 1 UNL1 -0.0496 24 C 1.8370 -1.3090 0.6280 C.ar 1 UNL1 -0.0178 25 C -2.8730 0.2960 0.4400 C.2 1 UNL1 0.2483 26 N -4.1720 0.0670 0.1630 N.am 1 UNL1 -0.2812 27 O -2.5230 1.3820 0.8600 O.2 1 UNL1 -0.2699 28 O -7.3170 -2.1410 -1.8820 O.3 1 UNL1 -0.4804 29 N 6.6360 -0.0930 0.2790 N.3 1 UNL1 -0.2957 30 N 8.2460 1.7300 -1.2000 N.3 1 UNL1 -0.3029 31 C 6.1250 1.2370 -0.0810 C.3 1 UNL1 0.0120 32 C 8.9150 2.2430 -2.4040 C.3 1 UNL1 -0.0127 33 O -7.4070 -1.0750 0.0520 O.2 1 UNL1 -0.2507 34 H -1.6530 -3.9860 -0.8100 H 1 UNL1 0.0618 35 H 0.7180 -3.5790 -0.3080 H 1 UNL1 0.0624 36 H -7.9350 2.2380 -1.1810 H 1 UNL1 0.0621 37 H -7.6720 3.9530 0.5640 H 1 UNL1 0.0618 38 H -5.7670 3.8490 2.1200 H 1 UNL1 0.0618 39 H -4.1230 2.0270 1.9380 H 1 UNL1 0.0636 40 H -6.9180 0.5280 -2.5060 H 1 UNL1 0.0427 41 H -5.3580 -0.1900 -2.0380 H 1 UNL1 0.0427 42 H 2.4590 -3.2860 0.0600 H 1 UNL1 0.0624 43 H 4.8330 -2.8730 0.5590 H 1 UNL1 0.0621 44 H 3.9070 1.1180 1.7460 H 1 UNL1 0.0621 45 H 1.5290 0.7220 1.2560 H 1 UNL1 0.0624 46 H 6.0520 0.1270 2.2850 H 1 UNL1 0.0476 47 H 6.4380 -1.5390 1.7900 H 1 UNL1 0.0476 48 H 8.4500 -1.0620 0.7130 H 1 UNL1 0.0439 49 H 8.3470 0.6280 1.2630 H 1 UNL1 0.0439 50 H 9.8360 0.4510 -0.7000 H 1 UNL1 0.0439 51 H 8.5260 -0.3060 -1.6380 H 1 UNL1 0.0439 52 H 6.4320 2.6990 -1.6340 H 1 UNL1 0.0439 53 H 6.5350 1.0090 -2.1840 H 1 UNL1 0.0439 54 H -0.2140 0.4240 0.8930 H 1 UNL1 0.0631 55 H -3.3130 -2.2050 -0.4730 H 1 UNL1 0.0625 56 H -4.4610 -0.8190 -0.1080 H 1 UNL1 0.1551 57 H -7.7820 -2.8830 -1.4710 H 1 UNL1 0.2951 58 H 6.3560 1.9430 0.7160 H 1 UNL1 0.0439 59 H 5.0450 1.1860 -0.2210 H 1 UNL1 0.0439 60 H 8.7360 1.5620 -3.2360 H 1 UNL1 0.0391 61 H 8.5180 3.2280 -2.6480 H 1 UNL1 0.0391 62 H 9.9870 2.3180 -2.2200 H 1 UNL1 0.0391 @BOND 1 32 30 1 2 30 19 1 3 30 20 1 4 33 11 2 5 19 18 1 6 20 31 1 7 18 29 1 8 31 29 1 9 11 28 1 10 11 10 1 11 29 17 1 12 6 7 ar 13 6 5 ar 14 10 5 1 15 17 14 1 16 7 8 ar 17 5 4 ar 18 13 14 ar 19 13 12 ar 20 14 15 ar 21 8 9 ar 22 12 24 ar 23 4 9 ar 24 4 26 1 25 26 25 am 26 15 16 ar 27 24 16 ar 28 24 3 1 29 21 3 ar 30 21 22 ar 31 25 22 1 32 25 27 2 33 3 2 ar 34 22 23 ar 35 2 1 ar 36 23 1 ar 37 1 34 1 38 2 35 1 39 6 36 1 40 7 37 1 41 8 38 1 42 9 39 1 43 10 40 1 44 10 41 1 45 12 42 1 46 13 43 1 47 15 44 1 48 16 45 1 49 17 46 1 50 17 47 1 51 18 48 1 52 18 49 1 53 19 50 1 54 19 51 1 55 20 52 1 56 20 53 1 57 21 54 1 58 23 55 1 59 26 56 1 60 28 57 1 61 31 58 1 62 31 59 1 63 32 60 1 64 32 61 1 65 32 62 1