IBS-ZINC02239991 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 0.3250 -2.3930 -0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1340 -2.6070 -1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 -1.5600 -0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6700 -1.8580 0.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4730 -0.8860 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2060 -1.1770 2.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9670 -0.1920 2.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0340 1.0690 2.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7210 1.9440 2.7640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3600 1.3290 1.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5850 0.3940 0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8960 0.6790 -0.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1010 -0.2930 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 -0.0110 -2.3490 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 -0.3360 -3.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0950 -0.8790 -3.5030 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 -0.0250 -4.8170 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.8460 0.9470 -4.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 -1.1020 -5.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9900 -2.4490 -5.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 -0.7330 -6.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3310 0.0030 -5.8900 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9880 1.4450 -6.3730 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8900 1.1420 -7.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3790 2.1250 -5.1880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6890 2.3970 -7.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 2.3380 -8.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 3.0840 -9.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 3.8910 -8.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 3.9500 -6.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 3.2070 -6.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 4.7040 -8.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1170 -2.5340 3.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9500 -3.1500 -1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6500 -1.4020 -1.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4140 -2.4730 0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 -2.5260 -2.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -3.5980 -0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5840 -2.8410 0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5210 -0.3730 3.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9740 1.6580 -1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4090 -1.1720 -4.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 -2.4040 -6.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 -3.2310 -5.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5970 -2.6730 -4.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 -0.5910 -7.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 0.1900 -6.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -1.5350 -6.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6060 -0.8220 -6.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 1.7080 -9.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 3.0380 -10.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 4.5800 -6.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0890 3.2560 -5.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 5.6810 -9.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 4.8320 -8.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 4.1880 -9.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2900 -2.5420 3.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0480 -2.7460 3.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9480 -3.2930 2.2420 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 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 13 2 0 0 0 0 4 5 2 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 40 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 2 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 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 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 33 57 1 0 0 0 0 33 58 1 0 0 0 0 33 59 1 0 0 0 0 M END