IBS-ZINC02258846 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7030 1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0930 1.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.7470 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -3.9650 -0.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -2.0140 -1.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6700 -1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0290 -0.0420 -2.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -2.6910 -2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -2.5180 2.4840 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -1.3980 3.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.3330 2.4800 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -1.3810 4.6310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -0.1030 5.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -0.3590 6.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2780 -0.4620 7.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -0.6980 8.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.8220 9.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 -0.7180 8.8330 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1100 -0.4880 7.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -3.9040 2.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5120 -4.3610 3.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1730 -4.1840 4.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 -4.6020 4.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1360 -5.1980 3.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4750 -5.3760 2.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1580 -4.9610 2.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1150 -5.9620 1.1290 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4680 -6.3680 1.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -2.8730 -2.8250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -2.0630 -3.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -3.6410 -2.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0820 -2.2140 5.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 0.4770 5.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 0.4530 5.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 -0.3610 6.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 -0.7840 9.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -1.0070 10.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0520 -0.4050 7.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 -3.9680 3.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 -4.5420 2.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6650 -3.7190 5.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9980 -4.4620 5.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1600 -5.5230 3.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 -5.1030 1.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0720 -5.5000 1.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5060 -7.0960 2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8600 -6.8190 0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 8 1 0 0 0 0 3 4 2 0 0 0 0 3 13 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 M END