IBS-ZINC05052296 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 58 0 0 1 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 1.0910 2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 3.0240 1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7480 3.4550 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8700 4.9150 0.0710 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 5.8140 -0.6740 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0400 5.6960 -0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4750 7.2450 -0.3940 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6560 7.0630 0.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 5.5960 0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6620 5.0840 1.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 7.9350 1.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 8.0480 0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4720 7.4850 0.9190 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3780 9.5140 0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 10.2630 0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 11.6360 0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 12.2750 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3530 11.5420 -0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 10.1670 -0.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 5.5180 -2.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 5.1960 -2.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3830 4.9240 -4.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 4.9730 -4.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 5.2970 -4.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 5.5750 -2.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 5.3460 -5.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 5.0530 -6.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2640 5.1560 -7.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 4.2310 -7.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 1.5250 2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 0.0040 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 1.3960 3.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 3.4700 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2370 3.3560 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 3.1230 -0.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7330 3.0090 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7880 7.7290 -1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 9.7660 1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4050 12.2160 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3470 13.3510 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1200 12.0470 -1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1440 9.5950 -1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1840 5.1560 -2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3370 4.6720 -4.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3170 4.7600 -5.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0080 5.8310 -2.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 4.0430 -6.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 5.7660 -6.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9160 5.9930 -6.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5910 4.3050 -8.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9830 3.3940 -8.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 56 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 56 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 56 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 21 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 29 30 2 0 0 0 0 29 53 1 0 0 0 0 30 54 1 0 0 0 0 30 55 1 0 0 0 0 M END