IBS-ZINC05345189 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 56 0 0 0 0 0 0 0 0999 V2000 -0.0590 1.4620 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 0.0590 0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -0.3510 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9420 0.7050 -0.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 1.8070 -0.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -1.6990 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5070 -2.2970 -1.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0580 -1.9320 -2.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 -2.8970 -3.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8190 -4.1390 -2.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3450 -4.5840 -1.3120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7020 -3.6060 -0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1370 -3.8340 0.5450 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 -2.6610 0.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 -2.6460 2.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -3.6990 3.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -3.1380 4.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -1.7760 4.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -1.4700 2.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9510 -0.6500 -2.8050 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4570 -0.3190 -4.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1380 1.1440 -4.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6100 1.5100 -5.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2190 3.1510 -7.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7590 4.5750 -8.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5850 5.5350 -7.3540 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5240 5.3820 -5.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0240 4.0010 -5.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8760 2.1350 0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -0.5620 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 2.7420 -0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3560 -4.8630 -3.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7680 -4.7490 2.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 -3.6600 5.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 -0.9330 4.7000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5140 0.0550 -2.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5420 -0.4740 -4.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9930 -0.9650 -4.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 1.3110 -4.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 1.7870 -3.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6980 1.4480 -5.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1400 0.8450 -6.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5520 2.4140 -8.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2520 2.9840 -8.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8350 4.7600 -9.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 4.7300 -7.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1570 6.1560 -5.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4970 5.5570 -5.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0620 3.8410 -5.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9220 3.8700 -4.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1880 2.9240 -6.1950 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2100 3.0400 -5.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 14 2 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 20 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END