IBS-ZINC05459053 MOE2007 3D Structure written by MMmdl. 51 55 0 0 1 0 0 0 0 0999 V2000 -1.8780 -1.0420 -1.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -0.9760 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -0.1820 -0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1540 1.2000 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 1.9410 0.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 1.3130 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3140 -0.0710 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 -0.8100 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 2.0970 0.1280 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4160 1.4070 0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7650 2.9020 -1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8980 3.9100 -0.9940 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8590 4.5810 -1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7280 4.8000 0.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0980 4.2380 1.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5950 3.0030 1.2800 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 2.7450 2.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 1.6000 3.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5010 1.7390 4.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6710 2.9630 5.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1400 4.1070 4.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4200 3.9520 3.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2780 3.2740 -1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0520 3.0870 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3080 2.4780 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7980 2.0530 -1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0570 2.2240 -2.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8020 2.8310 -2.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0020 1.4700 -1.2150 F 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 -1.6230 -1.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0810 -0.0410 -2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 -1.5180 -2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 -1.9910 0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1620 -0.5310 0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1110 1.7100 0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 3.0140 0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2620 -0.5920 -0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 -1.8810 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9330 2.2320 -2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8500 3.4680 -1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1010 5.7410 0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6530 0.6550 2.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1370 0.8750 5.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4360 3.0180 6.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 5.0510 5.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7050 3.4060 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9060 2.3330 0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4570 1.8860 -3.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2350 2.9590 -3.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9220 4.8420 2.3750 N 0 3 0 0 0 0 0 0 0 0 0 0 4.1760 5.8010 2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 16 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 23 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 50 2 0 0 0 0 16 17 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 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END