IBS-ZINC04082884 MOE2007 3D CORINA 3.40 0006 02.08.2006 82 86 0 0 1 0 0 0 0 0999 V2000 2.2290 0.7500 0.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 0.0200 1.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 0.5100 2.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4090 -1.2620 1.7480 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0510 -1.9870 2.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -1.8480 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 -2.7000 0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9640 -1.8850 1.4480 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0510 -1.2320 2.4070 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1410 -2.0070 3.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 -0.0380 3.1300 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2110 -0.5140 3.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 0.6520 4.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 1.6050 5.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 2.6330 4.1510 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2180 3.0690 3.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 3.7880 4.9850 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3240 4.4680 5.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 5.2560 4.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 6.3940 4.1560 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2780 7.0020 3.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 5.8280 3.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2940 4.7860 4.1580 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8830 5.3770 4.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3580 4.0940 3.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8540 2.9290 2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 1.9340 3.2900 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3140 0.9520 2.3330 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3690 0.2000 1.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6930 -0.8300 0.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 1.7480 1.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0120 1.1200 4.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 5.3220 2.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4650 7.0220 3.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 7.2160 5.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 3.2980 6.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -2.7980 2.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8220 -3.4270 1.2640 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7440 1.7000 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 0.1430 -0.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 0.9330 -0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 -0.0220 3.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3160 1.4450 2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0500 -1.0420 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 -2.4660 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 -2.7990 -0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -3.6820 0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -0.0910 4.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2250 1.2600 3.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 1.0370 5.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5030 2.1120 5.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 5.1480 6.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2840 3.7190 6.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3940 5.6730 5.2250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 4.6090 3.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1610 3.7400 3.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8340 4.8240 2.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7530 2.3770 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 3.2700 1.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0850 -0.3120 2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9090 0.9170 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -0.3530 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4680 -1.3320 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 1.1260 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 2.6350 1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 2.0480 1.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6350 1.7980 4.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6440 0.5150 3.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 0.4680 4.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2690 4.5450 2.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8510 4.9130 1.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 6.1480 1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 7.7710 2.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3370 6.6730 2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7850 7.4620 4.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 7.6220 5.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 2.4860 6.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 4.1210 6.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3550 2.9410 5.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3870 -3.5600 2.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5280 -2.2030 2.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -4.0190 1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 3 42 1 0 0 0 0 3 43 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 28 1 0 0 0 0 13 14 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 15 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 27 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 35 1 0 0 0 0 22 23 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 26 27 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 30 62 1 0 0 0 0 30 63 1 0 0 0 0 31 64 1 0 0 0 0 31 65 1 0 0 0 0 31 66 1 0 0 0 0 32 67 1 0 0 0 0 32 68 1 0 0 0 0 32 69 1 0 0 0 0 33 70 1 0 0 0 0 33 71 1 0 0 0 0 33 72 1 0 0 0 0 34 73 1 0 0 0 0 34 74 1 0 0 0 0 34 75 1 0 0 0 0 35 76 1 0 0 0 0 36 77 1 0 0 0 0 36 78 1 0 0 0 0 36 79 1 0 0 0 0 37 38 1 0 0 0 0 37 80 1 0 0 0 0 37 81 1 0 0 0 0 38 82 1 0 0 0 0 M END