IBS-ZINC05159210 MOE2007 3D Structure written by MMmdl. 54 57 0 0 1 0 0 0 0 0999 V2000 0.8080 -1.9410 -0.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 -0.4130 -0.9080 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2840 -0.0130 -1.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 0.0310 0.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 1.5600 0.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 2.0590 0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2030 1.5570 -0.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9520 -0.4330 -2.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4200 -0.2020 -1.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1700 -1.1610 -1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5280 -0.9570 -0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1370 0.1930 -1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3950 1.1690 -1.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0260 0.9700 -2.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3170 1.9220 -2.8160 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8700 3.0660 -3.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1740 3.3570 -3.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0140 2.4230 -2.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1980 2.6520 -2.2020 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6820 4.5360 -3.5070 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2630 4.5520 -4.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4180 3.3720 -5.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0040 3.3910 -6.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4460 4.5840 -7.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2990 5.7640 -6.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7080 5.7530 -5.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5630 6.9130 -4.5870 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0430 8.1060 -5.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5780 -2.3090 -0.6690 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 -2.3200 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -2.2550 -1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 -2.3360 -0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 -0.3800 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -0.3280 0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 1.9700 -0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4310 1.8790 1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5140 3.1490 0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 1.6800 1.3020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2380 1.8990 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 1.9480 -1.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7660 -1.5010 -2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6570 0.0820 -2.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1010 -1.7140 -0.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1900 0.3460 -1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 3.7850 -3.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0770 2.4390 -5.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1200 2.4720 -7.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9070 4.5940 -8.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6460 6.6940 -6.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1120 8.0110 -5.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5170 8.2620 -6.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8660 8.9560 -4.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 -3.0220 -1.3220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 0.0780 -0.8460 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 54 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 7 54 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 8 54 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 27 28 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 29 53 1 0 0 0 0 M END