IBS-ZINC01294395 MOE2007 3D Structure written by MMmdl. 52 54 0 0 0 0 0 0 0 0999 V2000 0.4310 -2.5960 -5.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8540 -2.6900 -6.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6840 -1.1870 -7.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9450 -0.3520 -8.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -1.7430 -4.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0860 -0.4410 -4.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6500 -0.6600 -2.8200 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9790 -1.0280 -2.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0540 -1.3030 -3.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2590 -1.6450 -2.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3720 -1.7060 -1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2850 -1.4280 -0.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1010 -1.0900 -1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0120 -0.4840 -1.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7170 -0.1150 -1.5240 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 0.2720 -0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 1.0920 -0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 0.5230 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 1.2500 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 2.5550 -0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 3.1360 -0.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 2.4090 -0.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 3.1680 -1.3080 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -2.6560 -4.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -3.4200 -5.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 -1.6580 -5.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4110 -3.6090 -6.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 -2.6540 -7.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0470 -2.1350 -7.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5360 -0.6180 -6.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0900 -0.8830 -8.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6200 -0.0950 -9.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5810 0.5830 -7.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8660 -2.2190 -4.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3540 -2.4490 -5.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8640 0.0060 -4.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2870 0.3040 -4.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9750 -1.2530 -4.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1350 -1.8680 -3.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3320 -1.9750 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3610 -1.4690 0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 0.0610 -2.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 -0.6360 0.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 0.8640 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -0.4930 0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 0.8010 0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2580 3.1200 -0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 4.1570 -1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8660 -0.7630 -0.6660 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.6540 -0.7470 0.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7670 -1.5040 -6.0820 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1450 -0.6910 -5.9610 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 27 1 0 0 0 0 2 28 1 0 0 0 0 2 51 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 51 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 51 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 8 1 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 49 2 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 49 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 49 1 M CHG 1 51 1 M END