IBS-ZINC03985275 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 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 3 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -2.0180 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8170 -2.6080 1.2200 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1160 -0.0040 1.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 1.2190 1.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 1.9000 2.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8010 1.7410 1.7180 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4390 1.0740 2.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3090 1.8070 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7610 2.2110 0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7480 1.2440 0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0790 1.6150 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4250 2.9520 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4380 3.9190 0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1070 3.5480 0.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8320 3.0810 2.3080 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5850 3.3040 3.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2350 2.4080 3.9100 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5980 4.6610 3.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3490 4.9700 5.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3280 6.2560 5.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5660 7.2360 4.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8160 6.9420 3.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8260 5.6550 3.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0880 5.3180 2.2310 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5510 5.9940 1.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1150 4.0660 1.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 3.8120 0.7520 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 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 2.8320 -0.5480 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2040 0.8280 -0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7270 2.5410 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4780 0.2000 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8500 0.8600 0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4650 3.2420 0.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7080 4.9630 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3360 4.3030 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9430 4.2090 5.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9080 6.5010 6.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5580 8.2390 5.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2260 7.7120 3.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -0.2240 0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -2.7050 1.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 -3.6700 1.2350 H 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 4 1 0 0 0 0 2 33 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 50 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 20 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 31 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 28 2 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 2 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 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 33 49 1 0 0 0 0 50 51 1 0 0 0 0 M END