IBS-ZINC02095215 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 72 0 0 1 0 0 0 0 0999 V2000 -1.7950 2.4240 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3200 0.9980 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 0.2870 1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -1.0210 0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 -1.6180 -0.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 -0.9070 -1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2130 0.3990 -1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -3.2850 -0.3780 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6370 -3.4310 -1.6880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 -3.5490 0.7990 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 -4.2560 -0.3050 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 -4.1800 -1.3560 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9060 -3.5160 -2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 -5.5760 -1.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2490 -6.0600 -2.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 -5.9280 -3.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2600 -6.4890 -4.1940 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6830 -6.5160 -5.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -7.0100 -3.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1220 -6.7580 -2.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1640 -7.1740 -0.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 -7.8210 -0.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 -8.0680 -1.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9860 -7.6730 -2.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 -3.6430 -0.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5920 -3.3540 0.3970 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6120 -3.4860 -1.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7070 -2.9140 -0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9280 -1.5480 -1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0350 -0.9600 -0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9340 -1.7360 0.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1230 -1.1350 0.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5630 0.1500 0.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6840 0.6400 1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3710 -0.1360 2.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9490 -1.4170 2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8240 -1.9280 1.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3100 -3.2850 1.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5200 -3.8510 3.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5960 -3.8810 0.9970 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7180 -3.1160 0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5990 -3.6940 -0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3520 -5.1730 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 3.0970 0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4730 2.6460 -0.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 2.5610 1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0860 0.7540 2.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 -1.5760 1.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 -1.3740 -2.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 0.9530 -2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 -4.8750 0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7520 -6.2620 -1.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3180 -5.5360 -2.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5940 -5.4500 -4.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 -6.9850 0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5600 -8.1430 0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 -8.5810 -1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7020 -7.8690 -3.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2300 -0.9480 -1.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2040 0.1010 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0340 0.7610 -0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0300 1.6390 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2440 0.2650 2.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4880 -2.0170 3.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7580 -5.3520 0.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3050 -5.6940 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8130 -5.5430 -0.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 1 46 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 47 1 0 0 0 0 4 5 1 0 0 0 0 4 48 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 49 1 0 0 0 0 7 50 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 51 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 14 15 1 0 0 0 0 14 52 1 0 0 0 0 14 53 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 54 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 55 1 0 0 0 0 22 23 2 0 0 0 0 22 56 1 0 0 0 0 23 24 1 0 0 0 0 23 57 1 0 0 0 0 24 58 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 42 2 0 0 0 0 29 30 2 0 0 0 0 29 59 1 0 0 0 0 30 31 1 0 0 0 0 30 60 1 0 0 0 0 31 32 1 0 0 0 0 31 41 2 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 61 1 0 0 0 0 34 35 1 0 0 0 0 34 62 1 0 0 0 0 35 36 2 0 0 0 0 35 63 1 0 0 0 0 36 37 1 0 0 0 0 36 64 1 0 0 0 0 37 38 1 0 0 0 0 38 39 2 0 0 0 0 38 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 43 65 1 0 0 0 0 43 66 1 0 0 0 0 43 67 1 0 0 0 0 M END