IBS-ZINC01863662 MOE2007 3D Structure written by MMmdl. 54 55 0 0 0 0 0 0 0 0999 V2000 6.0090 8.9080 -5.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7370 8.2370 -5.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7810 7.9970 -3.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4910 7.3210 -3.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4310 7.0260 -1.6440 N 0 3 0 0 0 0 0 0 0 0 0 0 3.5320 8.3330 -0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5710 6.0940 -1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 6.3440 -1.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7490 5.9360 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 5.3830 0.1660 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 6.2980 0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 6.2540 1.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5730 5.5090 1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1510 5.4380 3.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 6.1120 4.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 6.8590 3.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 6.9280 2.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2740 6.0190 5.6960 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 4.0260 0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6980 3.3540 -0.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 1.9800 -0.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 1.2860 0.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 1.9860 1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1540 9.8800 -5.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8860 8.2870 -5.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9550 9.0690 -6.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6050 7.2840 -5.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8770 8.8690 -5.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9220 8.9600 -3.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6520 7.3740 -3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3620 6.3580 -3.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 7.9550 -3.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4560 8.1080 0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5050 8.7910 -1.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 8.9910 -1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4950 5.1790 -1.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5240 6.5980 -1.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4860 5.8710 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 5.4560 -2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 7.0480 -1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8250 6.8000 0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 5.2060 0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 7.3300 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4850 6.0680 -0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0470 4.9770 0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 4.8570 3.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9490 7.3900 4.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 7.5160 2.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2210 3.8910 -1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5650 1.4550 -1.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 0.2160 0.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 1.5210 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7860 3.3060 1.1610 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3550 3.8220 1.8260 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 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 11 44 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 45 1 0 0 0 0 14 15 1 0 0 0 0 14 46 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 47 1 0 0 0 0 17 48 1 0 0 0 0 19 20 1 0 0 0 0 19 53 2 0 0 0 0 20 21 2 0 0 0 0 20 49 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 22 51 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 5 1 M CHG 1 53 1 M END