IBS-ZINC02411978 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 46 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 1.1910 -1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8590 0.5220 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0330 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7230 0.2240 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5170 0.8960 1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -0.6880 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7470 -0.2050 -0.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9350 -0.8760 -0.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0750 -2.0380 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2510 -2.9060 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0340 -3.9660 0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0870 -4.8760 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2440 -4.6870 0.5660 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4120 -3.6640 -0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4610 -2.7940 -0.4890 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8700 -6.2440 2.2780 S 0 0 0 0 0 0 0 0 0 0 0 0 9.5060 -7.0080 2.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5570 -8.2340 3.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5860 -8.5580 3.6690 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4050 -3.9220 1.6100 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9920 -2.4650 0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8480 -1.7740 0.6990 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9200 -0.1860 -1.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3380 1.2280 -1.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8280 0.9990 -1.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9070 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 1.5700 -2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 0.3760 -2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 -0.1520 2.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 1.0450 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3670 -3.5400 -0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6960 -7.2920 1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2660 -6.2970 2.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8980 -0.1220 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9930 -0.7170 -2.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7390 1.9310 -1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5280 1.5720 -2.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3280 0.7920 -2.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3820 1.8690 -1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6800 -8.9660 3.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6640 -9.7440 3.6670 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 23 2 0 0 0 0 8 9 2 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 22 2 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 24 35 1 0 0 0 0 24 36 1 0 0 0 0 25 26 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 41 42 1 0 0 0 0 M END