IBS-ZINC02339196 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 72 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6190 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1370 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8410 -0.4900 3.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8980 -1.8700 3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -2.6300 2.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6780 -2.0080 1.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 -2.7540 0.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1970 -4.1740 0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5910 -2.5480 4.3150 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5340 -3.6290 4.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0550 -2.1160 4.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7490 -2.6610 5.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 -3.0440 6.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7380 -3.5400 7.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0530 -3.6330 7.7410 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6970 -3.2630 6.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0640 -2.7880 5.5760 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0700 -3.3780 6.6030 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5880 -3.9200 7.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1170 -3.9570 7.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0280 -4.2390 5.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4980 -4.2020 5.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0090 -4.9030 6.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3990 -5.9420 5.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6250 -5.5710 4.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9830 -6.5210 3.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1160 -7.8490 3.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8890 -8.2230 5.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5350 -7.2640 5.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0820 -9.5690 5.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8260 -9.9500 4.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4520 -8.9610 3.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 -2.9300 6.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9190 -3.4410 7.6300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 -2.1500 5.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1650 1.2150 2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2940 0.1000 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3660 -3.7080 2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -4.4700 0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 -4.4890 1.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -4.6480 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5590 -2.4820 3.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1060 -1.0270 4.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2150 -3.8410 8.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2670 -3.2860 8.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2040 -4.9300 8.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5010 -2.9440 7.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5020 -4.3850 8.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3480 -4.8730 4.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4110 -3.2290 5.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1140 -5.2150 5.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1130 -3.7730 4.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3760 -5.2010 7.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4460 -3.9430 6.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5210 -4.5370 4.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1590 -6.2280 2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3630 -7.5510 7.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8980 -9.9080 4.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5350 -10.9460 3.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 -1.0810 5.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -2.4010 5.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5460 -4.7810 6.6760 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 37 1 0 0 0 0 13 14 1 0 0 0 0 13 47 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 49 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 22 67 1 0 0 0 0 23 24 1 0 0 0 0 23 54 1 0 0 0 0 23 55 1 0 0 0 0 23 67 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 25 26 1 0 0 0 0 25 58 1 0 0 0 0 25 59 1 0 0 0 0 25 67 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 60 1 0 0 0 0 28 29 1 0 0 0 0 28 61 1 0 0 0 0 29 30 2 0 0 0 0 29 34 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 31 62 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 33 63 1 0 0 0 0 33 64 1 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 37 65 1 0 0 0 0 37 66 1 0 0 0 0 M END