IBS-ZINC02241210 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7010 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0880 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7730 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0730 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0390 0.1890 -2.6980 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.7750 2.3590 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -4.2010 2.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -4.7860 3.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -3.9890 4.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -6.1640 3.8370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -6.7080 5.1280 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -8.0780 5.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 -8.9590 4.3300 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1870 -10.2090 4.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 -11.5050 4.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2220 -12.5390 5.1540 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -12.3600 6.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -11.1640 7.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 -10.0710 6.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -8.7190 6.5070 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 -8.0820 7.8270 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4970 -8.8000 8.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 -7.4960 8.1530 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7440 -7.2890 7.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 -6.1830 8.9050 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2760 -5.3270 8.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -6.1310 8.9440 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0340 -6.5490 9.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -6.9460 7.8300 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1540 -4.6920 8.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 -4.6500 8.9290 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -6.2240 10.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9300 -8.3910 8.9880 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -11.7020 2.9470 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1660 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -3.8520 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6050 -2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 -4.5460 1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9690 -4.5220 1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1180 -4.4080 5.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -2.9180 4.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -6.7500 3.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -6.1220 5.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2500 -13.2280 7.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 -4.3320 7.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 -4.0580 9.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 -3.7660 8.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -5.4240 10.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8120 -8.0720 9.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 -10.9400 2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -12.6030 2.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 41 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 2 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 14 1 0 0 0 0 13 48 1 0 0 0 0 14 15 1 0 0 0 0 14 49 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 32 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 36 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 35 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 33 1 0 0 0 0 33 34 1 0 0 0 0 33 51 1 0 0 0 0 33 52 1 0 0 0 0 34 53 1 0 0 0 0 35 54 1 0 0 0 0 36 55 1 0 0 0 0 37 56 1 0 0 0 0 37 57 1 0 0 0 0 M END