IBS-ZINC05032396 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 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 1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -2.0050 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3110 -2.6320 2.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 -1.8710 3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -0.4750 3.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 0.1430 2.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5740 -2.5370 4.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 -1.9040 5.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 -2.9020 6.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3720 -4.1140 5.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 -3.8670 4.4610 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6930 -5.3890 6.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3120 -6.5120 5.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5450 -7.8640 5.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1480 -8.1660 6.8060 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0700 -8.7780 4.9630 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4150 -8.3820 3.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7210 -9.3840 2.6600 S 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 -6.6100 3.9100 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2590 -10.2040 5.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0830 -10.7200 6.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 -12.1870 6.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2550 -12.7600 5.9450 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 0.2260 -2.5930 0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 -3.7110 2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 0.1170 3.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 1.2210 1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2620 -0.8370 5.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2370 -2.7550 7.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2410 -5.4770 7.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3100 -10.7550 4.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1860 -10.3460 5.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0320 -10.1700 7.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -10.5790 5.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -12.8560 7.0810 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 -13.7950 7.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 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 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 15 21 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 22 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 40 41 1 0 0 0 0 M END