IBS-ZINC02259538 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 1 0 0 0 0 0999 V2000 0.0200 1.6700 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 0.1410 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 -0.4300 -1.2220 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2360 -0.0260 -2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -1.9320 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4140 -2.6120 -0.6790 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 -2.5720 -1.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7010 -3.9650 -1.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7810 -4.5580 -2.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7420 -3.7770 -3.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6280 -2.3980 -3.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 -1.7900 -2.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1160 -0.0610 -1.1940 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0260 -0.3420 -0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2410 0.1980 -0.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0510 0.7670 -1.7800 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 0.6170 -2.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 1.0780 -3.3350 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8900 0.4270 -4.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 0.9070 -5.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 3.0200 -4.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 2.5400 -3.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7520 2.8610 -7.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3420 0.0630 0.2420 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2250 -0.5810 1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2010 -0.6900 2.1350 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0540 -1.1060 1.8200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9480 -1.0060 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8940 -1.4870 1.4300 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9790 -1.7990 3.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6350 0.6220 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 2.0180 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 2.0030 -0.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 2.0770 0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 -0.1930 0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 -0.2070 0.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -4.5760 -1.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8770 -5.6330 -2.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5850 -4.2470 -3.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 -1.7960 -3.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 -0.7140 -2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9480 0.6850 -4.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 -0.6540 -4.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6960 0.4470 -6.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 0.6250 -5.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 2.7620 -4.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 4.1010 -4.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8890 3.0000 -2.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4270 2.8220 -3.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 2.5900 -7.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 2.4140 -7.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 3.9460 -7.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9580 -1.7840 3.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2540 -1.2960 3.7490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6690 -2.8310 2.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7160 1.6470 0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4390 0.0220 0.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7130 0.6130 -1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3260 2.3690 -5.8720 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 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 13 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 59 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 59 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 23 59 1 0 0 0 0 24 25 1 0 0 0 0 24 31 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 30 1 0 0 0 0 28 29 2 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 M END