IBS-ZINC02147037 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 64 0 0 1 0 0 0 0 0999 V2000 0.2550 -1.6940 2.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 -0.3400 2.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 0.7500 1.9000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1310 0.7140 0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 2.1200 2.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1920 0.5200 1.5760 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3180 -0.4670 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 1.5720 0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4400 2.4240 0.9670 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 1.5620 -0.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6970 2.5270 -1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9060 3.1420 -1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3930 4.1260 -2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6840 4.5090 -3.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4680 3.9080 -3.4790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 2.9040 -2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6890 2.2720 -2.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 2.6820 -4.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 3.6900 -4.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0020 4.0490 -5.8790 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 4.2730 -4.5720 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2870 2.0600 -4.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 1.1960 -2.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7120 4.7870 -1.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9810 0.6050 2.8080 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0160 -0.6220 3.2140 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6620 -0.2210 4.4150 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2740 -1.8280 3.0970 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2650 -0.6830 1.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4200 0.0630 2.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4000 0.0150 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2250 -0.7790 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0710 -1.5260 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0930 -1.4810 0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2930 -0.8300 -1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -1.8730 1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -2.4830 2.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 -1.6900 1.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7930 -0.1180 3.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8770 -0.3760 3.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 2.1840 3.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 2.9010 1.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4950 2.2510 2.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4720 2.8540 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0760 5.2790 -3.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 2.6250 -3.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4030 2.0760 -5.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3160 1.0290 -4.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 1.6040 -1.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 0.8340 -2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 0.3710 -1.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5180 4.2300 -2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7030 5.8100 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8680 4.7980 -0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8970 1.3800 3.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5560 0.6840 2.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3020 0.5990 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9340 -2.1460 -0.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1930 -2.0680 0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9990 -1.6280 -0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8330 -1.0230 -2.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8210 0.1230 -1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 39 1 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 25 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 14 15 2 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 26 27 2 0 0 0 0 26 28 2 0 0 0 0 26 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 56 1 0 0 0 0 31 32 1 0 0 0 0 31 57 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 58 1 0 0 0 0 34 59 1 0 0 0 0 35 60 1 0 0 0 0 35 61 1 0 0 0 0 35 62 1 0 0 0 0 M END