IBS-ZINC04762731 MOE2007 3D Structure written by MMmdl. 44 45 0 0 1 0 0 0 0 0999 V2000 -1.3820 8.0540 0.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4370 7.2100 1.2470 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3590 7.2970 0.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7590 7.8120 2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7980 7.4130 3.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 6.3560 3.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 5.4360 2.4030 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0930 4.4210 2.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0830 5.7030 1.3850 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.9660 5.2410 1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 4.9630 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5750 4.6160 -2.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6820 4.8910 -3.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9990 4.2550 -2.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3860 4.6930 -1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2740 4.4270 -0.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 5.4310 1.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8260 8.2570 4.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1170 7.6310 -0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7730 9.0610 0.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4700 8.1740 1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7630 7.4880 2.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7970 8.9060 2.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 6.1080 4.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7070 3.8880 0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 5.3550 -0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 3.5470 -2.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6670 5.1610 -2.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3880 4.5050 -4.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8180 5.9740 -3.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7900 4.5300 -3.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9060 3.1630 -2.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6260 5.7640 -1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2950 4.1670 -1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0630 3.3570 -0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5540 4.8430 0.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 6.3690 1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 5.2690 2.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 4.6170 1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1250 7.8980 5.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 9.2920 4.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8280 8.2510 5.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9980 5.1040 -0.9350 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.1960 6.1080 -1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 4 23 1 0 0 0 0 5 6 2 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 17 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 16 36 1 0 0 0 0 16 43 1 0 0 0 0 17 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 43 44 1 0 0 0 0 M CHG 1 43 1 M END