IBS-ZINC05458853 MOE2007 3D Structure written by MMmdl. 45 49 0 0 1 0 0 0 0 0999 V2000 9.3740 3.8400 0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9550 4.1680 -0.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5940 4.1880 -0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6340 3.8790 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0720 3.5520 1.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4330 3.5320 1.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1610 3.9060 -0.2150 C 0 0 3 0 0 0 0 0 0 0 0 0 5.0580 4.0570 -1.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4240 5.0180 0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 5.0100 0.0840 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8850 5.3940 -0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 3.6330 0.0270 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 3.1870 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 3.8590 -0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 3.0560 -0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1390 1.6510 -0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 0.9810 -0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1970 1.7900 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2630 2.5680 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6100 2.5820 0.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 5.8710 1.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8030 5.4430 2.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 6.2620 3.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 7.5220 2.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 7.9590 1.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7180 7.1470 0.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4650 9.5150 0.9380 Cl 0 0 0 0 0 0 0 0 0 0 0 0 10.4340 3.8270 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6910 4.4110 -1.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2940 4.4500 -1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3580 3.3120 2.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7620 3.2790 2.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 4.8530 1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8770 5.9970 0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 4.9380 -0.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1680 3.5310 -0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0570 1.0730 -0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -0.0990 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1600 1.7300 0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1190 4.4660 2.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8080 5.9180 4.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 8.1560 3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9680 7.5160 -0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5220 1.4690 0.0840 N 0 3 0 0 0 0 0 0 0 0 0 0 2.8820 0.5240 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 20 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 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 21 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 44 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 27 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