IBS-ZINC04937329 MOE2007 3D Structure written by MMmdl. 41 44 0 0 0 0 0 0 0 0999 V2000 7.7960 4.3810 -1.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2900 3.7220 -0.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8700 1.8440 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7430 0.8590 -0.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5440 1.5680 -0.6360 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 2.5760 -1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8360 3.5620 -1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 1.1300 -0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 1.9100 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 1.3340 0.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 2.3490 0.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 2.3610 0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0790 3.5750 0.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4410 4.7610 0.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0840 4.7690 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 3.5470 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 3.2580 -0.1090 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6010 3.9570 -0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7520 3.6030 1.2450 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 0.0200 0.7250 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9980 -0.6560 0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 -0.1820 0.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0300 3.6380 -2.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0680 5.0860 -2.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7100 4.9440 -1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9680 4.4560 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0840 3.0990 -0.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6160 2.4520 1.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8040 1.3040 0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5560 0.2560 0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0750 0.1740 -0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9710 2.0600 -2.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7990 3.1350 -1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5760 4.1660 -0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0400 4.2140 -2.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8830 1.4370 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9970 5.6960 0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 5.6940 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9620 -1.7150 0.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1200 2.8100 -0.9900 N 0 3 0 0 0 0 0 0 0 0 0 0 6.3690 2.2360 -1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 22 2 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 40 1 M END