IBS-ZINC06759157 MOE2007 3D Structure written by MMmdl. 54 57 0 0 0 0 0 0 0 0999 V2000 -2.9760 1.1110 0.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 -0.2820 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2140 -1.4270 0.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4130 -2.5140 0.1990 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1580 -2.0920 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 -0.7040 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1280 -0.0940 -0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 -0.9040 -0.8190 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 -2.2340 -0.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 -2.9120 -0.5180 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4270 1.2500 -0.2500 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 1.8800 -1.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8210 3.3550 -1.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 3.4280 0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2120 1.9460 1.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 5.5480 -0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8070 -3.9130 0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 -4.5400 1.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9500 -5.9620 1.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2210 -6.2420 2.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6860 -7.5560 2.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8880 -8.6020 1.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6240 -8.3330 1.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 -7.0190 1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6410 -1.5610 0.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8860 1.5210 1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4360 1.7550 -0.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0310 1.1500 -0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 -2.8280 -1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2680 1.8030 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0460 1.3740 -2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1920 3.4610 -1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5340 3.8600 -2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 3.5580 0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0640 3.9720 1.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5640 1.4790 1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 1.8770 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 6.0050 0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3740 5.9530 -0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3930 5.6990 -0.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8820 -3.9740 0.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 -4.4410 -0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 -4.5180 1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8900 -3.9530 2.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8560 -5.4360 2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6720 -7.7660 2.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2510 -9.6250 1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 -9.1460 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -6.8260 0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7530 -2.3110 1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0300 -0.6180 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2600 -1.8520 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 4.0750 -0.1560 N 0 3 0 0 0 0 0 0 0 0 0 0 1.7930 3.9620 0.2360 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 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 13 53 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 14 53 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 16 38 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 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 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END