IBS-ZINC05033170 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 0.2720 1.5640 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 0.0850 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -0.5260 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 -1.9870 1.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -2.6980 0.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4590 -2.5140 2.5850 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4640 -1.7420 3.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5980 -2.2790 4.7630 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3270 -0.4090 3.6470 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1680 0.2540 2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 1.4640 2.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 0.3450 4.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 0.4610 5.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 1.5350 5.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1370 1.6420 5.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6330 0.6760 6.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8410 -0.3970 6.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 -0.5020 6.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -0.6440 -1.1300 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -0.3180 -2.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 -0.9680 -3.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0200 -0.6490 -4.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9810 0.3280 -3.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9740 0.9780 -2.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0260 0.6510 -1.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9980 0.6730 -4.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0020 0.1070 -6.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1570 1.7980 0.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4450 1.8470 -1.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 2.1160 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5620 -3.4740 2.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7500 1.3410 4.7240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 -0.1750 5.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4620 2.2890 4.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7560 2.4800 5.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6390 0.7590 6.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2280 -1.1520 7.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 -1.3380 6.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4900 -1.3930 -1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3300 -1.7230 -3.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0220 -1.1530 -5.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7140 1.7340 -2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0230 1.1500 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9230 1.6150 -4.7240 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5690 1.8060 -5.4170 H 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 2 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 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 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 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 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 44 45 1 0 0 0 0 M END