IBS-ZINC05207558 MOE2007 3D Structure written by MMmdl. 49 52 0 0 0 0 0 0 0 0999 V2000 0.0100 1.2050 0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 1.6740 1.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1650 1.9010 1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 2.3230 2.3630 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 2.5750 3.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8120 3.0180 4.7630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7010 3.0560 5.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 2.6850 5.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 2.3810 3.7360 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 1.9230 2.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2850 1.7400 2.8720 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 1.9870 4.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5310 1.6740 3.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3700 1.9310 5.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7830 1.6210 4.8340 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4020 0.3970 5.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7140 0.5460 4.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6940 2.4920 4.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2070 3.3330 5.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9980 3.9830 4.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3330 4.2930 4.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8920 3.9600 5.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1150 3.3180 6.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7790 3.0080 6.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8740 1.6230 0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 0.2180 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 1.1180 0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1730 1.9050 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6670 3.3480 6.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8070 1.3880 2.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9610 3.0380 4.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6910 1.3500 4.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6440 0.6280 3.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9090 2.2840 2.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3010 2.9810 5.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0200 1.3190 5.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8170 -0.4210 5.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5730 -0.0990 4.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5190 3.5280 4.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5840 4.2600 3.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9340 4.7950 3.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9300 4.2010 5.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5480 3.0540 7.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2010 2.4970 7.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7100 0.5860 -0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9510 1.7800 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5060 2.3030 -0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8590 1.8450 4.2850 N 0 3 0 0 0 0 0 0 0 0 0 0 8.7250 2.2660 3.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 10 2 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 19 1 0 0 0 0 7 8 2 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 17 48 1 0 0 0 0 18 39 1 0 0 0 0 18 48 2 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 48 49 1 0 0 0 0 M CHG 1 48 1 M END