IBS-ZINC01304930 MOE2007 3D Structure written by MMmdl. 52 56 0 0 0 0 0 0 0 0999 V2000 -0.1020 4.5710 -3.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4710 4.6380 -2.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 3.7490 -1.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8610 2.8090 -1.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 2.7750 -2.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 3.6110 -3.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 1.6510 -2.9140 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0720 0.9280 -3.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 -0.1350 -2.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 1.1080 -1.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 1.7890 -0.8030 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 1.0930 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 1.6140 1.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 -0.4240 2.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 -0.9110 3.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -0.1120 5.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 1.3810 4.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 1.8600 3.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3980 -1.2050 -3.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3020 -2.4760 -2.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1440 -3.5190 -3.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0980 -3.3110 -4.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2080 -2.0510 -4.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3630 -1.0070 -4.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3640 -1.7100 -6.0460 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -7.1010 -4.6410 -4.6680 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 5.2800 -4.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 5.4030 -2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 3.8260 -0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 3.5390 -4.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2080 1.2490 -4.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 0.0210 0.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3770 1.2020 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9090 2.7040 1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 1.3660 1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3070 -0.5590 3.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1670 -0.9550 2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 -0.8350 3.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 -1.9720 4.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -0.4390 5.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -0.3090 5.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8470 1.5970 4.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 1.9370 5.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 2.9110 3.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 1.7350 4.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5600 -2.6900 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0440 -4.4980 -2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4830 -0.0330 -4.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9470 0.0030 -1.7070 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.1170 -0.6050 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 1.0560 2.6910 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8840 1.1840 2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 8 31 1 0 0 0 0 9 19 1 0 0 0 0 9 49 1 0 0 0 0 10 11 1 0 0 0 0 10 49 2 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 13 51 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 51 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 18 44 1 0 0 0 0 18 45 1 0 0 0 0 18 51 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 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 48 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