IBS-ZINC03984853 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 55 0 0 0 0 0 0 0 0999 V2000 0.0870 1.3720 0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -0.1580 0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3780 -0.6470 0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -2.1770 0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 -2.2900 1.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8300 -4.0930 0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2550 -4.5030 -0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2990 -5.9460 -0.5850 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4590 -6.5350 -0.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4880 -5.8860 -0.9580 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4820 -7.9590 -1.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4650 -8.9380 -0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4900 -10.3450 -0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4750 -11.3630 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4990 -12.6810 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5380 -13.0040 -1.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5530 -12.0080 -2.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5300 -10.6720 -2.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5460 -9.6760 -3.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5740 -9.9240 -3.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5300 -8.3750 -2.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5500 -7.5290 -3.5660 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5620 -14.3070 -1.8720 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6020 -14.5700 -3.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4830 -13.6710 0.8040 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4420 -13.2700 2.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4260 -8.5950 1.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 1.7200 0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3350 1.7450 -0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 1.7400 1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -0.5270 -0.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -0.5310 1.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9690 -0.2780 1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8000 -0.2740 -0.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 -2.5450 -0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9780 -2.5500 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5860 -1.2060 1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1370 -2.7500 2.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6000 -2.6490 1.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5270 -4.6260 0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1510 -4.3440 -0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9340 -4.2530 0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5580 -3.9710 -1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4930 -6.4780 -0.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4440 -11.1140 1.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5830 -12.2680 -3.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6170 -15.6470 -3.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4990 -14.1230 -3.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7200 -14.1420 -3.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4340 -14.1550 2.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5410 -12.6840 2.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3200 -12.6660 2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4920 -7.6430 1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7860 -2.6460 0.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 4 54 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 5 54 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 6 41 1 0 0 0 0 6 54 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 44 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 25 1 0 0 0 0 16 17 2 0 0 0 0 16 23 1 0 0 0 0 17 18 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 23 24 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 M END