IBS-ZINC05206835 MOE2007 3D Structure written by MMmdl. 41 44 0 0 0 0 0 0 0 0999 V2000 -2.6450 3.7380 7.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4990 3.3880 5.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 3.1830 4.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5970 2.8720 3.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2870 2.7680 2.9300 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 2.9790 3.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 3.2940 5.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 2.8080 2.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 2.4820 1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9190 2.4600 1.6530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 2.1710 0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3020 2.9630 3.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 2.3050 4.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0620 2.4530 4.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9430 3.2590 4.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5180 3.9190 3.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 3.7700 2.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5660 3.4440 4.8150 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -4.7510 2.6930 2.6800 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8330 3.0730 1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0920 2.7900 0.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9400 2.1230 3.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3360 1.4330 4.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 4.7330 7.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6910 3.7360 7.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0950 3.0090 7.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6920 3.3470 5.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 1.5670 0.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 3.0950 -0.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4650 1.6080 -0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 1.6730 5.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3890 1.9380 5.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2020 4.5520 2.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 4.3030 1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9920 3.5380 0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6160 2.9160 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6840 2.1970 4.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1420 0.7400 4.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4710 0.8870 4.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7490 2.2320 1.9500 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.7100 1.9000 1.9320 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 19 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 8 9 1 0 0 0 0 8 12 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 34 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 40 2 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 40 41 1 0 0 0 0 M CHG 1 40 1 M END