IBS-ZINC06661466 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3830 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 1.1970 -0.6900 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0100 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4140 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7900 1.8390 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5370 0.6980 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7210 -0.3840 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0240 -1.3050 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2930 3.2190 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5120 4.1520 -0.0100 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6200 3.4530 -0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1880 5.0080 -0.0300 S 0 0 0 0 0 0 0 0 0 0 0 0 7.6060 4.9190 -0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4680 5.6990 -1.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7400 5.6910 1.4100 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6410 5.6020 2.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1740 6.9400 2.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1090 8.0040 3.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7760 8.5550 1.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 7.8860 1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4900 6.3820 1.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9080 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5520 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 -1.7700 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 3.1740 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6160 0.6620 -0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2440 2.7090 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0720 5.2620 3.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4580 4.9090 2.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8260 6.8950 3.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7720 7.2410 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2250 7.5550 3.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5040 8.7920 3.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6120 9.6300 1.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6090 8.3700 1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 8.3650 1.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 8.0050 0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7660 5.8920 0.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1410 6.2760 2.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 2 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 20 34 1 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 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 M END