IFLAB-ZINC02699219 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 63 0 0 1 0 0 0 0 0999 V2000 0.1680 1.1100 0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -0.4070 0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -0.8420 -1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 -1.1860 -1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7680 -1.5830 -2.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0890 -1.6490 -3.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -1.3000 -3.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -0.9000 -2.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -1.3680 -4.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -1.7770 -5.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 -2.1030 -5.7370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -1.8840 -7.4400 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7590 -0.6740 -7.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 -2.3280 -8.3560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2300 -3.1730 -7.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5530 -2.8680 -7.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4930 -3.8780 -7.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1080 -5.1960 -7.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 -5.5000 -7.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -4.4880 -7.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 -6.4660 -7.0730 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 -1.0360 -4.8520 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 0.3700 -4.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9900 0.7390 -4.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8960 -0.1720 -3.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6100 -1.6320 -4.2780 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8470 -1.7980 -5.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1300 -1.9330 -4.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4570 -2.5390 -3.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9310 -3.3470 -2.6940 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7950 -2.4500 -3.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5470 -3.3540 -2.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0450 -3.1060 -2.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 1.3870 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 1.6000 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 1.4250 1.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 -0.8970 0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0050 -0.6840 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6270 -1.1360 -0.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8140 -1.8450 -2.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 -0.6360 -2.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 -2.4210 -6.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8540 -1.8390 -6.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5270 -3.6400 -6.7990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4820 -6.5280 -7.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -4.7260 -7.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 0.5120 -3.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 1.0080 -5.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1580 1.7780 -4.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2160 0.6110 -5.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6970 -0.0160 -2.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9400 0.0580 -4.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9200 -2.9680 -4.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8970 -1.7800 -2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3130 -4.3840 -2.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2790 -3.1800 -1.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3130 -3.2800 -3.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6090 -3.7860 -2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2790 -2.0760 -2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7190 -2.0360 -4.5820 N 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 8 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 40 1 0 0 0 0 6 7 1 0 0 0 0 6 60 2 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 11 42 1 0 0 0 0 11 60 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 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 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 22 23 1 0 0 0 0 22 28 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 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