IBS-ZINC02107945 MOE2007 3D Structure written by MMmdl. 46 48 0 0 0 0 0 0 0 0999 V2000 -0.4020 3.0970 5.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 3.4070 5.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5770 3.1270 4.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9730 3.4070 4.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6400 3.1630 3.4430 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5770 4.0050 5.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9370 4.3140 5.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4610 4.8680 6.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6460 5.1240 7.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2950 4.8220 7.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7470 4.2590 6.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 3.9550 6.6810 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1810 5.6750 9.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5810 5.9630 9.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9920 6.5650 10.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1030 6.7450 11.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4280 6.9610 10.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9560 2.5740 3.3990 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 3.4120 2.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5330 4.7840 2.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0040 5.6340 1.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3680 5.1190 0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 3.7510 0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7880 2.8930 1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 1.5470 1.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 3.9610 5.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 2.8640 6.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 2.2410 4.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5720 4.1170 4.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5130 5.1080 6.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6710 5.0230 8.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7920 6.6680 8.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1380 5.0420 8.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0740 6.4610 11.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3980 7.1760 12.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9740 6.1170 10.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4660 7.8020 11.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8830 7.2500 9.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 5.1900 3.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 6.7040 1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 5.7860 -0.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 3.3510 -0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 18 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 35 1 0 0 0 0 16 36 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 19 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 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 M END