IBS-ZINC02586313 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 62 0 0 1 0 0 0 0 0999 V2000 -2.6910 0.1630 0.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0480 -1.1840 0.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 -1.3890 1.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 -2.6370 0.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8290 -3.6830 0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1470 -3.4910 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7490 -2.2400 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 -4.9880 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -5.4210 1.0210 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2590 -5.6850 -1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2990 -7.0160 -1.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2870 -7.3300 -2.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -8.4620 -3.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 -6.1320 -3.4240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 -4.9910 -2.5150 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1520 -4.4510 -2.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 -4.0830 -2.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -2.7280 -3.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 -1.8880 -3.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1680 -2.3800 -3.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3800 -3.7200 -2.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 -4.5650 -2.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1370 -1.4570 -3.4760 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4880 -1.9140 -3.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3510 -0.7690 -3.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3740 -0.2760 -3.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -6.0160 -4.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 -5.6060 -5.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -6.5270 -7.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 -4.5530 -7.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 -7.9720 -0.3390 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 0.7750 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7730 0.0660 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 0.6820 1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 -0.5800 1.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 -2.7870 1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7290 -4.3030 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7770 -2.0960 -0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -2.3100 -3.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6940 -0.8390 -3.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3760 -4.1460 -2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 -5.6100 -2.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7660 -2.2540 -2.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6190 -2.7300 -4.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1130 -0.3230 -4.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6500 -0.6840 -2.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9580 0.5580 -3.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6100 -5.2980 -5.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -6.9890 -5.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2800 -6.3850 -5.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8760 -4.6890 -4.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -7.2380 -7.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 -6.9540 -7.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1260 -6.2180 -8.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7120 -3.6300 -6.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5070 -5.1880 -7.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4800 -4.3130 -8.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -8.8330 -0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -5.3020 -6.9520 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.6130 -4.6690 -7.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 59 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 59 1 0 0 0 0 30 55 1 0 0 0 0 30 56 1 0 0 0 0 30 57 1 0 0 0 0 30 59 1 0 0 0 0 31 58 1 0 0 0 0 59 60 1 0 0 0 0 M CHG 1 59 1 M END