IBS-ZINC06759273 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 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 -0.7130 1.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.0970 1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7420 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.1060 -1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.7160 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -0.1850 -2.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -1.1810 -3.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -2.7690 -2.8030 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -0.8040 -4.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 0.4860 -5.2130 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 1.4070 -4.2670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 1.1010 -2.9930 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -1.7670 -5.9020 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 -1.3620 -7.3100 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6900 -0.4610 -7.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -1.0810 -7.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6830 -2.4700 -8.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5470 -2.1680 -9.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0950 -3.1840 -9.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 -4.5010 -9.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9150 -4.8030 -8.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 -3.7870 -7.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -2.8760 2.4360 C 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 0.0260 -0.1940 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 2.4480 -4.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -2.7080 -5.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3210 -0.7800 -8.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 -0.2800 -7.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 -1.9820 -7.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7930 -1.1390 -9.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 -2.9480 -10.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 -5.2950 -10.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 -5.8320 -8.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 -4.0220 -7.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 -3.0770 2.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5890 -3.8190 2.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5770 -2.2950 3.2010 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 14 2 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 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 24 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END