IBS-ZINC01827132 MOE2007 3D Structure written by MMmdl. 46 47 0 0 0 0 0 0 0 0999 V2000 1.2550 1.3140 5.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 0.9260 5.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5570 0.7640 2.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6280 2.2230 2.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8230 -0.9260 3.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 -1.1960 2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -3.1470 1.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5030 -2.3430 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 -2.2530 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 -3.4010 -0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -4.8030 -0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8080 -5.8060 -1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6530 -7.1630 -0.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8380 -7.5560 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1780 -6.5860 0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2960 -5.1980 0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 -4.4110 1.4740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 0.4780 5.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 2.1380 5.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 1.6440 6.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2400 1.7870 5.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0560 0.0880 5.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4330 0.4480 3.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4800 0.1390 2.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7350 2.5170 1.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7250 2.8920 3.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4980 2.3850 1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 -1.5820 3.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1590 -1.1140 4.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 -0.5110 2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7040 -1.0580 1.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1180 -1.3230 0.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -2.7750 -0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5110 -2.2370 0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2630 -1.3150 -0.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6010 -3.3170 -0.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 -3.2640 -1.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4680 -5.5190 -2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1730 -7.9030 -1.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 -8.6120 0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 -6.9460 1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2130 -4.8950 2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 0.5180 3.7890 N 0 3 0 0 0 0 0 0 0 0 0 0 1.5780 1.1440 3.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5330 -2.5890 2.3480 N 0 3 0 0 0 0 0 0 0 0 0 0 0.7210 -3.1810 3.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 2 43 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 3 43 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 5 29 1 0 0 0 0 5 43 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 7 45 2 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 17 42 1 0 0 0 0 43 44 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 43 1 M CHG 1 45 1 M END