IFLAB-ZINC02712694 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 56 0 0 1 0 0 0 0 0999 V2000 0.2460 -1.2250 1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -0.4920 0.1440 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0260 0.5740 0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 -1.0390 -1.0780 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5830 -0.8960 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 -2.5090 -1.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 -3.4470 -0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 -4.7950 -0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3280 -5.2060 -1.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 -4.2680 -1.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 -2.9190 -1.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -0.8290 -3.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2040 -0.1160 -4.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 1.8390 -3.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 1.1250 -2.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 2.0480 -5.7750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6710 -0.6990 -0.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 0.1000 0.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9760 1.3560 1.6290 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.8720 -0.0910 0.4590 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7800 0.6680 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6020 2.0390 1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5010 2.7850 2.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5780 2.1680 2.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7580 0.8030 2.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8660 0.0520 1.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0980 -1.6610 1.6530 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 -2.2720 1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3320 -1.1610 1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 -0.7650 2.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -3.1260 -0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5730 -5.5280 -0.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 -6.2590 -1.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1700 -4.5880 -2.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6900 -2.1860 -2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -1.9020 -3.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 -0.6390 -3.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -0.4690 -5.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8600 -0.3290 -4.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 1.6480 -3.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 2.9110 -3.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3280 1.3380 -2.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 1.4780 -1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 1.8550 -5.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 1.7010 -6.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 3.1180 -5.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9940 -1.4110 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1950 -0.7540 -0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7620 2.5220 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3620 3.8520 2.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2780 2.7540 3.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6000 0.3250 3.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -0.3240 -2.2810 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 1.3330 -4.5720 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 17 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 53 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 53 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 54 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 54 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 53 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 16 54 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 24 25 2 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 M END