IBS-ZINC02277630 MOE2007 3D Structure written by MMmdl. 52 56 0 0 0 0 0 0 0 0999 V2000 2.0340 6.7240 0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 5.4460 0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 3.2520 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 1.8680 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 1.1560 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 1.8400 -0.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4140 3.2440 -0.5780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 3.9290 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 5.2930 -0.0710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 6.3870 -0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -0.2470 -0.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 -0.9020 0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7300 -2.3010 0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -4.4240 0.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3950 -5.5730 -0.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -6.7790 0.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 -6.8090 1.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4280 -5.6380 1.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0450 -4.4430 1.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 -3.1080 1.6180 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3560 -2.6580 2.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6190 -2.1740 1.9720 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1060 -0.8820 2.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2800 -0.4350 1.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9840 -1.2740 0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5200 -2.5630 0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3470 -3.0130 1.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9080 7.3310 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 7.2020 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0850 6.4850 0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9340 1.3730 0.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1900 1.2620 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3180 3.7620 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 6.6640 -1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 6.0750 -0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 7.2470 0.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -0.3740 1.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0770 -5.5340 -1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4170 -7.7170 -0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1400 -7.7720 1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 -5.6660 2.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5930 -3.4670 3.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 -1.8640 3.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 -0.2120 2.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6550 0.5640 1.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9020 -0.9270 0.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0770 -3.2210 -0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0140 -4.0290 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 4.2230 0.4670 N 0 3 0 0 0 0 0 0 0 0 0 0 2.7850 4.0520 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -3.1060 -0.0450 N 0 3 0 0 0 0 0 0 0 0 0 0 0.5680 -2.7460 -0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 9 1 0 0 0 0 2 49 2 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 3 49 1 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 20 1 0 0 0 0 13 51 2 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 14 51 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 49 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 49 1 M CHG 1 51 1 M END