IBS-ZINC04834653 MOE2007 3D Structure written by MMmdl. 40 42 0 0 0 0 0 0 0 0999 V2000 -5.1880 0.8280 0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8810 1.8430 2.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8570 1.4290 1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 1.5810 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8810 2.1010 0.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2380 1.2900 0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3690 -0.1080 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6530 -0.6550 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7730 0.1590 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6370 1.5470 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 2.1250 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 3.4770 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5120 3.4440 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 4.6420 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 5.8390 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 4.6910 -0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 7.0890 0.1550 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6580 4.6400 0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7910 4.5100 0.6480 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0780 -0.1850 1.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2260 1.1640 0.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8450 0.8840 -0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2980 2.5930 3.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9270 2.1560 2.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7860 0.8590 3.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7470 0.4050 1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 2.1130 2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8280 2.2370 -0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 0.6110 -0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 -0.7660 0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7770 -1.7350 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7640 -0.2870 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5270 2.1650 -0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6330 4.8150 -0.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 7.9550 0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1000 7.2030 0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3440 1.7600 1.5000 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.4510 2.7210 1.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 5.7850 -0.0620 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2770 6.6830 -0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 37 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 13 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 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 17 1 0 0 0 0 15 39 1 0 0 0 0 16 34 1 0 0 0 0 16 39 2 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 3 0 0 0 0 37 38 1 0 0 0 0 39 40 1 0 0 0 0 M CHG 1 37 1 M CHG 1 39 1 M END