IBS-ZINC02126366 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 63 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0240 -0.8300 1.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.1150 0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -2.1020 -0.6440 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.7660 -1.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -3.2790 -1.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 -3.7010 -1.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9840 -3.3500 -2.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2850 -3.7370 -3.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9900 -4.4780 -2.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3960 -4.8320 -1.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0890 -4.4490 -0.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -4.8010 0.3040 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 -5.5700 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 -3.3510 -4.5630 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.1690 -3.1000 -5.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8400 -2.1610 -4.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0800 -2.0700 -4.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6370 -0.8050 -4.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8660 -0.1810 -4.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0580 1.0640 -4.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0800 1.6650 -3.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8590 1.0630 -3.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6400 -0.1880 -3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5690 -1.0380 -3.6130 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7430 -0.8700 -3.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2350 1.7130 -4.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3850 2.9920 -3.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6910 -3.1390 -5.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5650 -4.0720 -6.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -3.3400 1.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.5010 2.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5340 -3.0330 -2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -4.0940 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 -2.7710 -3.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0060 -4.7790 -2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9470 -5.4100 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1760 -5.0080 1.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5780 -6.5070 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6960 -5.7830 2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6280 -0.6450 -5.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2790 2.6360 -2.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1080 1.5420 -2.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.3670 3.4000 -3.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2910 2.8860 -2.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6120 3.6670 -4.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4250 -3.7060 -5.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1720 -2.6810 -6.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9960 -4.9590 -6.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9380 -3.5520 -6.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 -3.6500 1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5840 -4.1460 1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 -3.1110 2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7470 -4.4740 -5.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1660 -5.2680 -5.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 6 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 2 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 58 1 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 30 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 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 28 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 28 29 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 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 30 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 58 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 58 59 1 0 0 0 0 M END