IBS-ZINC02271582 MOE2007 3D Structure written by MMmdl. 47 48 0 0 1 0 0 0 0 0999 V2000 1.7120 2.3610 1.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 2.4040 0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0360 1.9860 -0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1580 1.4840 0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 1.8090 0.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 3.2330 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9340 3.5870 1.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0870 2.5910 1.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5850 1.1490 1.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6190 0.8150 0.2220 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1600 0.9010 -0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 -1.3180 -0.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8690 -1.7090 -1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3680 -2.5110 -2.9960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5610 -3.7320 -2.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 -3.3490 -1.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 -2.5490 -0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0590 1.3520 2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 3.0300 1.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0150 2.6810 2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7660 3.4410 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 0.9650 -0.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 2.0310 -1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9050 2.6540 -0.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 0.4430 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 3.9760 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 3.3210 -0.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3330 4.5950 1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3940 3.6070 2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7290 2.6980 0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7070 2.8200 2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4510 0.4740 1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0880 0.9960 2.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 -0.6120 -1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6060 -2.3100 -1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3930 -0.8190 -2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7440 -1.8680 -3.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2190 -2.8310 -3.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -4.2420 -3.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 -4.4450 -2.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -2.7550 -2.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -4.2540 -1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -2.2450 0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -3.1960 0.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 -0.6400 0.3620 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.0740 -1.1680 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5800 -0.7160 1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 21 1 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 25 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 34 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 45 46 1 0 0 0 0 45 47 1 0 0 0 0 M CHG 1 45 1 M END