IBS-ZINC04028994 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 42 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.8040 1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.0860 0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -2.0700 -0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -0.8220 -1.1350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -3.3150 1.5290 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4180 -3.0510 2.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 -3.8960 1.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 -5.2210 1.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0120 -5.3950 1.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8370 -6.5240 1.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1970 -6.3080 1.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7180 -5.0320 1.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9170 -3.9040 2.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5480 -4.0940 1.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 -3.2140 1.8190 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5760 -2.2530 1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0420 -7.3720 1.8090 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4330 -7.0980 1.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 -6.2600 1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -5.6130 1.6360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.4780 2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -2.9370 -1.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4350 -7.5170 1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7850 -4.9170 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3360 -2.9180 2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9950 -8.0320 1.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5880 -6.6100 2.9490 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7790 -6.4420 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6800 -7.1050 1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5240 -6.5990 0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -5.4470 2.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6480 -6.2720 1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 -4.3250 0.9360 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -4.4350 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 38 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 19 1 0 0 0 0 14 15 2 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 20 31 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 38 39 1 0 0 0 0 M END