IBS-ZINC05255069 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 58 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6180 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -2.0030 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -2.6260 2.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 -1.8690 3.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -0.4880 3.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 0.1390 2.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5870 -2.5500 4.3100 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5280 -3.6300 4.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0320 -2.1310 4.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9360 -2.6960 3.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5110 -3.6430 2.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4110 -4.1700 1.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7500 -3.7860 1.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1980 -2.8720 2.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2980 -2.3050 3.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7210 -1.3570 4.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8230 -0.8290 5.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4730 -1.2110 5.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -0.6470 6.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4490 -1.2490 6.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9070 -2.1680 5.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -2.7680 5.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -2.3900 7.1350 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -1.4660 7.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 -0.9290 7.5780 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 -2.9810 7.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -4.2380 8.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2640 -4.8560 8.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0180 -6.0300 9.5800 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -2.5950 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 -3.7040 2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 0.1000 3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 1.2170 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4760 -3.9500 2.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0820 -4.8980 0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4440 -4.2200 0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2390 -2.5850 2.5470 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7560 -1.0500 4.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1540 -0.1000 5.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2250 -1.1720 8.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 -2.2610 8.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7730 -3.2450 6.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -4.9580 7.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -3.9740 9.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8230 -4.1350 9.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8430 -5.1200 7.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8200 -6.4740 9.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -3.6640 5.1630 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 -3.9190 4.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 23 1 0 0 0 0 11 12 1 0 0 0 0 11 20 2 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 53 2 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 28 47 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 53 54 1 0 0 0 0 M END