IBS-ZINC06759962 MOE2007 3D Structure written by MMmdl. 50 54 0 0 0 0 0 0 0 0999 V2000 -0.9540 1.7380 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 1.0380 -0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3860 1.7430 -0.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 3.8090 -0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 3.1220 -0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 5.1650 -0.7010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 5.9300 -1.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 7.1740 -0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 7.9490 -0.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 7.2150 0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 5.9490 -0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2430 9.2790 -0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 9.9810 -1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 9.7290 -2.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 10.8080 -3.4200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7430 11.7640 -2.8440 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 11.3240 -1.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7750 12.0520 -0.9830 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 11.3040 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1200 9.9970 0.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 13.1030 -3.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 13.2540 -4.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 13.8330 -3.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7240 13.9380 -4.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 13.4640 -6.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 12.8790 -6.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 12.7730 -5.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9250 13.5950 -7.2270 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 1.2130 0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2630 -0.0400 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 1.2720 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8980 3.6590 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 6.2440 -2.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 5.3320 -1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5900 6.8510 0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9310 7.7510 -1.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 6.9270 1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 7.8020 0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 5.3610 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 6.2340 -1.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 8.8000 -2.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0210 11.8100 0.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6660 13.2890 -3.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6380 13.8180 -2.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7630 14.1960 -2.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6540 14.3880 -4.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 12.5000 -7.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 12.3000 -6.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 3.0730 -0.6430 N 0 3 0 0 0 0 0 0 0 0 0 0 2.1830 3.5670 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 49 2 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 4 49 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 20 2 0 0 0 0 13 14 1 0 0 0 0 13 17 2 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 49 1 M END