IBS-ZINC00727901 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.0950 1.5060 -0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 0.0140 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 -0.6200 -0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -2.0170 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -2.7090 0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1290 -2.0090 0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1580 -2.6090 0.5650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.6750 0.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 0.0450 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6500 0.3980 1.6980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 1.6360 2.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 1.9170 3.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0920 0.9610 4.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4480 -0.2060 3.8220 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2520 -0.5060 2.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -4.1990 0.3760 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4950 -4.4560 1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5210 -4.6640 0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5760 -3.8800 0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 -2.6530 -0.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8470 -4.3500 0.4860 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 -5.9620 1.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9410 -6.9910 1.5950 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 -4.8800 -0.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1380 -4.6970 -2.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3770 -5.3200 -3.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 -6.1300 -3.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0980 -6.3150 -1.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5720 -5.6920 -0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1960 -7.1090 -1.7310 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7600 -7.2520 -0.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0050 -6.7440 -4.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -6.5080 -5.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 1.8790 -0.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8250 1.7360 -1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3950 1.9830 0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 -0.0600 -0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3890 0.9580 -0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2400 -0.5860 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7930 2.3640 1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 2.8710 3.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2730 1.1720 5.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5620 -1.4700 2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9790 -5.2330 0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6130 -3.8000 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 -4.0650 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -5.1750 -4.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 -5.8370 0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6280 -7.9090 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0180 -7.6820 0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0660 -6.2750 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3520 -5.4420 -5.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3030 -6.8490 -5.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8430 -7.0550 -6.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 16 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 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 14 2 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 24 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 3 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 48 1 0 0 0 0 30 31 1 0 0 0 0 31 49 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 33 52 1 0 0 0 0 33 53 1 0 0 0 0 33 54 1 0 0 0 0 M END