IBS-ZINC06759087 MOE2007 3D Structure written by MMmdl. 57 60 0 0 0 0 0 0 0 0999 V2000 1.8370 6.1740 -1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 5.4820 -0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 3.3800 0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 1.9100 0.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4680 1.1660 -0.2820 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2700 1.7570 -1.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 3.2220 -1.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -0.1830 -0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 -0.7850 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 -0.3560 0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1850 -1.4940 0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 -2.5870 0.2340 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 -2.1750 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -3.0050 -0.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 -2.3370 -0.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -1.0060 -0.7480 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7670 -3.9840 0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4540 -4.5570 1.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9450 -5.9770 1.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2300 -6.2400 2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6940 -7.5530 2.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 -8.6120 2.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6030 -8.3600 1.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1370 -7.0480 1.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6230 -1.6160 0.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9480 1.0370 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7350 5.9820 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 5.8530 -2.0920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 7.2560 -1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2650 5.5940 -1.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 5.8990 0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 3.4910 0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 3.9550 1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5730 1.4640 1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 1.8680 1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 1.6950 -1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 1.2140 -2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 3.3080 -2.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 3.6870 -2.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8640 -2.9400 -1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8350 -4.0560 0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2460 -4.5410 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -4.5240 1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9100 -3.9400 2.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8770 -5.4230 2.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6910 -7.7500 2.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2420 -9.6340 2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9680 -9.1840 1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 -6.8670 1.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7550 -2.3370 1.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0250 -0.6600 1.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2180 -1.9410 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8860 1.4860 1.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3920 1.6550 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9950 1.0610 -0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 4.0030 -0.2870 N 0 3 0 0 0 0 0 0 0 0 0 0 1.8140 3.9020 0.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 56 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 56 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 7 56 1 0 0 0 0 8 9 1 0 0 0 0 8 16 2 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END