IFLAB-ZINC00755250 MOE2007 3D Structure written by MMmdl. 47 50 0 0 0 0 0 0 0 0999 V2000 -3.3490 -0.2970 3.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5090 -0.9400 2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4950 -2.3240 2.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7400 -2.9060 1.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -2.1440 0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 -0.7560 0.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7700 -0.1600 1.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -0.0760 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 -0.7120 -1.0570 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 -2.0490 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3070 -2.7710 -0.2410 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 -2.7050 -2.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8270 -1.9510 -3.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1960 -2.5930 -3.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 -4.7770 -2.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9890 -4.1570 -2.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3450 -4.7190 -4.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 1.3870 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 2.1350 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 3.5240 -1.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2580 4.1870 -0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 3.4630 0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 2.0730 0.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3420 -0.0660 3.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4590 -0.9590 4.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8850 0.6280 4.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0730 -2.9620 3.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 -3.9890 1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8050 0.9230 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2400 -1.9300 -4.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0070 -0.9090 -2.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8600 -2.5040 -2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6700 -2.1330 -4.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 -4.6750 -1.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 -5.8350 -2.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 -4.6490 -1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 -4.3900 -3.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1490 -5.7660 -4.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7440 -4.1980 -4.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0280 -4.6380 -3.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9380 1.6330 -2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 4.0870 -2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 5.2680 -0.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 3.9800 1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 1.5270 1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0400 -4.0770 -3.7070 N 0 3 0 0 0 0 0 0 0 0 0 0 2.4160 -4.1650 -4.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 11 2 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 15 46 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END