IBS-ZINC05459213 MOE2007 3D Structure written by MMmdl. 45 49 0 0 1 0 0 0 0 0999 V2000 5.4260 0.4370 4.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2570 -0.1990 3.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1480 0.0970 2.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2080 1.0340 1.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3820 1.6670 2.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4910 1.3690 4.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1180 1.2910 0.3940 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1510 1.3960 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4880 0.1360 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9850 0.0760 -0.1140 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7940 -0.2580 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4180 1.4240 -0.2130 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0740 1.8140 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 1.0960 -0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 1.8490 -0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 3.2510 -0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 3.9680 -0.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 3.2080 -0.3790 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 2.5230 -0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4990 2.5860 0.1040 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3310 -0.8850 -1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 -0.5520 -2.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 -1.4580 -3.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 -2.7100 -2.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3370 -3.0640 -1.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -2.1570 -0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -3.8260 -3.9610 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.5090 0.2080 5.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9900 -0.9240 4.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8110 -0.4150 1.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 2.4020 2.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8460 1.8670 4.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9590 -0.8250 -0.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6730 0.3140 -1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 0.0190 -0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2590 1.3350 -0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2220 3.7890 -0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 5.0460 -0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9930 3.4690 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 0.4190 -2.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4210 -1.1830 -4.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 -4.0440 -1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0650 -2.4580 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 3.5860 -0.3390 N 0 3 0 0 0 0 0 0 0 0 0 0 2.7310 4.5440 -0.3850 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 20 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 21 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 44 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 44 45 1 0 0 0 0 M CHG 1 44 1 M END