IBS-ZINC02094805 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 -0.1570 1.7080 -0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 0.2050 -0.3090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -0.4120 0.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -1.7910 1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -2.5530 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -1.9360 -1.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -0.5570 -1.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -4.3100 -0.0380 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 -4.7650 -1.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6580 -4.6140 1.2230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 -4.8600 0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3700 -4.6680 -1.1300 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0300 -3.8120 -1.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3470 -5.9220 -2.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 -6.1010 -2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -6.8400 -1.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 -7.0040 -2.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 -6.4290 -3.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -5.6900 -4.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 -5.5300 -3.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7750 -4.4210 -0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0110 -4.4060 0.5400 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7640 -4.2160 -1.5300 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0230 -4.1040 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8380 -5.2230 -0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1230 -5.1100 -0.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5840 -3.8560 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7480 -2.7360 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4820 -2.8660 -0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4420 -1.4790 -0.6700 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -9.9430 -3.7480 0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7060 -4.8710 0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1800 -6.0960 0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8740 -7.0950 0.1500 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9340 -6.1880 -0.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4800 -2.4280 1.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8560 2.1090 -0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 1.9970 -1.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 2.1050 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 0.1830 1.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.2730 1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -2.5310 -2.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1340 -0.0760 -2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -5.3090 0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 -6.7930 -1.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0720 -5.8150 -2.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -7.2900 -0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9850 -7.5820 -1.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5450 -6.5560 -4.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8540 -5.2400 -5.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 -4.9560 -4.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4730 -6.1790 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1000 -1.7740 0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7120 -4.8270 0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9650 -1.9060 0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2050 -2.6010 1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6600 -1.8200 1.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 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 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 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 42 1 0 0 0 0 7 43 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 44 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 18 19 2 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 20 51 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 35 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 31 32 2 0 0 0 0 31 36 1 0 0 0 0 32 33 1 0 0 0 0 32 54 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 36 55 1 0 0 0 0 36 56 1 0 0 0 0 36 57 1 0 0 0 0 M END