IFLAB-ZINC02713636 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 1 0 0 0 0 0999 V2000 -0.3930 1.7290 -0.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2080 0.2270 -0.4660 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1840 -0.2480 -0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -0.0040 0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -1.5070 0.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 -2.0630 -0.2460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 -1.8180 -1.4370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 -0.3800 -1.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 -2.4240 -2.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5600 -2.0530 -3.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3160 -1.0620 -2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5490 -0.7260 -2.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0690 -1.3680 -4.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3510 -2.3380 -4.6490 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0800 -2.7020 -4.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -4.0040 -4.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -3.4160 -3.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 -3.9280 -2.6990 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 -2.7400 -2.4600 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 -4.9420 -3.5990 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -4.7080 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 -3.9920 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 -4.6030 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 -5.9320 1.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2520 -6.6490 0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4210 -6.0380 -1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -6.7010 2.8680 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.3020 -1.0390 -4.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8510 0.2070 -4.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6640 0.3050 -2.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2620 0.2460 -2.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 2.2040 -0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9740 1.8930 -1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9180 2.1610 0.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 0.5040 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 0.3880 1.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4600 -1.6750 1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1170 -2.0100 1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5160 -1.5690 -0.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7050 -3.1350 -0.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -0.2290 -2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5010 0.1060 -1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9240 -0.5640 -1.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7610 -2.8230 -5.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6330 -4.7750 -4.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3010 -2.9540 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 -4.0430 2.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -7.6870 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 -6.5990 -1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9130 0.2460 -4.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3310 1.0310 -4.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1730 -0.5260 -2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0720 1.2490 -2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3610 -3.6480 -4.7920 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 2 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 54 2 0 0 0 0 16 17 2 0 0 0 0 16 45 1 0 0 0 0 16 54 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 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 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 49 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END