IBS-ZINC02202118 MOE2007 3D Structure written by MMmdl. 59 61 0 0 1 0 0 0 0 0999 V2000 -6.6010 2.2170 8.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6940 2.4620 7.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7460 3.5660 6.7070 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.7260 3.3120 7.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0860 4.9330 7.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8000 3.6050 5.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7850 4.4950 4.5820 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0400 5.7610 4.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2120 6.5080 3.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0870 7.7600 3.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8480 8.2330 2.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6760 7.4760 2.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8190 6.2400 3.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 4.2040 4.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7160 2.9450 4.8250 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.4810 2.2510 5.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7640 3.1860 6.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0740 2.3080 3.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8770 1.5530 2.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 0.9910 1.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 1.1760 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 1.9280 2.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7240 2.4900 3.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4210 0.5790 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 1.6170 -1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 0.9540 -2.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 2.2570 -1.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5690 2.0190 9.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9750 3.0710 9.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2070 1.3480 8.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7310 2.7070 6.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4540 1.5210 6.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0070 4.9210 8.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3950 5.7030 6.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1040 5.2390 7.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7940 3.9150 4.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6370 2.6060 4.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1630 6.1460 4.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9720 8.3850 3.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8030 9.2120 2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7180 7.8250 2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 3.9610 5.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3200 3.5350 6.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 2.2700 6.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9310 1.3920 2.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9920 0.4120 0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 2.0820 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 3.0670 3.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0960 -0.1940 -0.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 0.0510 0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 2.4150 -0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 0.1480 -2.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 1.6830 -3.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 0.5270 -1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 2.9560 -2.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0840 1.5000 -2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9260 2.8220 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9000 5.2620 3.8320 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.9180 5.3040 3.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 14 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 12 2 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 58 1 0 0 0 0 14 15 1 0 0 0 0 14 58 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END