IBS-ZINC02220650 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 56 0 0 0 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 0.6710 -0.4650 -1.1740 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -1.8100 -1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4150 -2.3240 -2.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 -3.6880 -2.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -4.5520 -1.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3530 -4.0320 -0.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 -2.6670 -0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 -6.0190 -1.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -6.9520 -0.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3390 -8.1820 -1.4490 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 -9.0400 -1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 -7.9700 -2.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 -6.6810 -3.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -9.0190 -3.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3440 -10.3550 -3.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3420 -11.3410 -4.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -11.0430 -5.7820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 -9.7110 -6.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 -8.6740 -5.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 -7.3460 -5.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -7.0680 -6.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -8.0860 -7.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 -9.3870 -7.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -6.6800 0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -7.4620 1.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7980 -7.2020 2.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 -6.1690 3.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3050 -5.3900 2.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 -5.6420 1.0690 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8260 -1.6550 -3.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 -4.0880 -3.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -4.6980 0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 -2.2630 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 -10.6300 -2.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 -12.3730 -4.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -11.8370 -6.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 -6.5470 -4.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5780 -6.0440 -7.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 -7.8400 -8.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -10.1660 -8.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -8.2690 1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -7.8070 3.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6830 -5.9700 4.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9300 -4.5840 2.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7630 -5.0360 0.3660 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 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 2 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 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 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 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 2 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 M END