IBS-ZINC06764289 MOE2007 3D Structure written by MMmdl. 54 58 0 0 0 0 0 0 0 0999 V2000 -10.4210 4.8160 0.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9190 3.6130 1.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7780 2.7410 2.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2460 1.6530 3.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8680 1.4530 3.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0220 2.3390 2.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6590 2.2140 2.3310 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8640 2.5960 1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8220 1.5130 0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0350 1.1520 1.9790 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8810 0.6580 3.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8830 1.7450 3.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6380 1.2900 2.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8290 1.0300 1.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 1.1950 1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 1.5750 2.3290 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6270 1.8490 3.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0220 1.7320 3.2770 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6310 2.1100 4.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6310 2.4240 5.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 2.2780 4.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 2.5230 5.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 1.7000 4.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 1.9390 5.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5010 3.0010 6.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4280 3.8250 6.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 3.5870 6.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 0.8900 0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1390 4.5190 0.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9090 5.5030 1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6020 5.3520 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8530 2.9080 2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9010 0.9590 3.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4660 0.5840 3.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3550 3.5430 1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5010 2.7540 0.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1910 1.8960 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3300 0.6170 0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4310 -0.2230 2.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2970 0.3140 3.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3500 2.6080 3.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5180 1.3570 4.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 0.6750 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 2.7460 6.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9210 0.8590 4.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1430 1.2930 5.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4840 3.1870 6.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5750 4.6560 7.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 4.2510 6.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1990 0.0650 0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 1.7740 -0.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 0.6100 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5960 3.3770 1.7450 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.9640 4.0380 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 53 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 53 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 13 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 41 1 0 0 0 0 12 42 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 21 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 22 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 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END