IBS-ZINC01467945 MOE2007 3D Structure written by MMmdl. 45 48 0 0 0 0 0 0 0 0999 V2000 4.9030 1.3000 -0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5550 1.9810 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3210 1.1640 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 1.7270 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 3.0950 -0.3330 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 3.9380 -0.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 3.7170 -0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3200 4.8400 -0.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 6.1300 -0.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 6.3550 -0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 5.2370 -0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 3.8610 -0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4210 3.3100 -0.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5050 4.2030 -0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3450 4.9830 -0.8550 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 1.0250 0.1320 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7460 0.8270 1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 1.3900 2.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 1.1730 3.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1450 0.3870 3.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6030 -0.1830 2.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9050 0.0350 1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0020 0.1220 5.2270 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.4810 -0.3340 0.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6180 -1.1240 -1.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6140 -1.9850 -1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0580 0.8180 0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9960 0.5550 -1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7400 1.9930 -0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9280 2.7380 -0.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4020 4.7100 -0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4810 6.9680 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 7.3400 -1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 0.5970 -0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 2.0110 2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 1.6220 4.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4990 -0.7980 2.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2810 -0.4250 0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3160 -0.5240 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6130 -0.7360 0.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -1.0100 -1.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6470 -2.5420 -2.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4130 -2.1620 -0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7590 5.1300 -0.7010 N 0 3 0 0 0 0 0 0 0 0 0 0 2.3980 5.9070 -0.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 13 2 0 0 0 0 3 4 2 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 5 6 1 0 0 0 0 5 12 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 44 2 0 0 0 0 13 14 1 0 0 0 0 14 15 3 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 25 26 2 0 0 0 0 25 41 1 0 0 0 0 26 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