IBS-ZINC05035051 MOE2007 3D Structure written by MMmdl. 46 48 0 0 0 0 0 0 0 0999 V2000 8.2850 11.4990 1.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0680 10.0210 1.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9510 9.5280 2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7630 8.1530 2.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6980 7.2450 2.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8280 7.7420 1.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0120 9.1180 1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4780 5.7630 2.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1480 3.5800 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7560 2.9370 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4100 3.3420 -0.5900 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3810 4.8140 -0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7170 5.5360 0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4090 2.8370 0.1760 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4170 2.3840 -0.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2050 1.7910 0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 1.1710 -0.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 0.5700 -0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 0.5870 0.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 1.2030 1.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 1.8090 1.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8420 2.5690 2.6550 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 -0.1520 1.5160 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.8490 11.8750 2.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8370 11.7310 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3290 12.0310 1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2180 10.2160 3.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8790 7.8020 3.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5840 7.0680 1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9010 9.4820 0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7010 5.5280 3.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4100 5.2910 2.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4800 3.2790 2.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1800 3.3210 1.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7950 1.8450 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4910 3.1990 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0880 5.1180 -1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3910 5.1340 -1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9870 5.3190 1.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7600 6.6150 0.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4540 2.4150 -1.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 1.1400 -1.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 0.0910 -1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 1.2130 2.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0840 5.0950 1.0880 N 0 3 0 0 0 0 0 0 0 0 0 0 7.7740 5.3850 0.3850 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 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 30 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 45 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 9 45 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 45 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 45 1 M END