IBS-ZINC02216454 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 63 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.6980 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0830 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7770 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0670 -1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6870 -1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 0.1960 -2.6970 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.2560 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 -5.0840 0.4320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4450 -6.3980 0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -6.2910 -0.3610 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 -5.0550 -0.5160 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 -4.7360 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 -7.3350 0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -8.5470 0.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5200 -6.6610 1.1990 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 -5.2210 1.0790 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2560 -4.7590 2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3190 -4.5780 0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7990 -5.2430 -0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7670 -4.6550 -1.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2560 -3.4030 -1.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7750 -2.7340 -0.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8080 -3.3280 0.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2540 -1.5020 0.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7240 -7.2660 1.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5210 -7.4790 3.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7590 -8.1020 3.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8810 -9.4780 3.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0150 -10.0510 4.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0330 -9.2440 4.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9080 -7.8640 4.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7700 -7.2960 4.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1500 -9.8060 5.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1560 -8.9140 5.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.7660 2.3700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1600 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.5970 -2.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4180 -6.2220 -1.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1400 -5.1760 -2.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0110 -2.9440 -1.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4360 -2.8120 1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0240 -1.5160 0.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5760 -6.6050 1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9140 -8.2260 1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 -8.1410 3.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3320 -6.5200 3.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0880 -10.1060 3.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1100 -11.1260 4.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6990 -7.2340 5.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6700 -6.2210 4.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7390 -8.2880 6.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5070 -8.2840 5.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9920 -9.4910 6.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 -2.9750 2.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 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 41 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 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 27 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 54 1 0 0 0 0 34 55 1 0 0 0 0 35 36 1 0 0 0 0 36 56 1 0 0 0 0 36 57 1 0 0 0 0 36 58 1 0 0 0 0 37 59 1 0 0 0 0 M END