IBS-ZINC02122821 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 56 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7430 -0.5450 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0350 -1.0890 1.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 -1.4390 0.8900 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 -0.9780 -0.3710 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1240 -0.1020 -0.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 -0.6310 -1.4020 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2510 -2.1640 -0.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8610 -2.4450 -2.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5150 -3.6520 -2.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5590 -4.5850 -1.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9400 -4.3170 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2740 -3.1000 0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4990 -2.5570 1.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4680 -3.0370 2.3850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9820 -5.2300 0.9630 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0790 -5.1440 1.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2080 -5.7660 -1.4420 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8210 -5.9760 -2.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 0.6180 2.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 0.9240 1.9220 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4850 1.3180 2.8490 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 2.4480 3.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 3.0560 4.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 2.5950 5.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3180 3.1520 6.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0970 4.1700 5.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8670 4.6300 4.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 4.0770 3.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 -0.5610 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8290 -1.7220 -2.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9930 -3.8670 -3.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0680 -4.1710 2.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9920 -5.9300 2.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0150 -5.2640 1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0610 -5.9340 -3.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5670 -5.2010 -2.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3030 -6.9530 -2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 1.0740 2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 2.1000 4.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 3.1990 2.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 1.8000 6.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 2.7920 7.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8850 4.6040 6.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 5.4250 4.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 4.4390 2.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9130 -0.1990 -0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -1.6500 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9800 -0.2300 0.8140 H 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 8 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 21 1 0 0 0 0 5 6 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 17 18 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 20 42 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 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 28 29 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 31 51 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 M END