IBS-ZINC00522034 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 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 0.6270 -0.6190 1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 0.1360 2.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8440 -0.4970 3.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 -1.8990 3.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -2.6480 2.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6770 -2.0130 1.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -2.7500 0.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -4.1720 0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5840 -2.2630 4.3120 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7620 -3.1760 4.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9760 -1.1350 5.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5420 -0.0030 4.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8100 1.2090 4.7920 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4740 1.3450 5.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9020 0.3070 6.6140 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6780 -0.9370 6.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1330 -2.0180 6.9440 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8370 -1.5710 8.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9370 -2.7250 9.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9070 -4.0650 8.3940 S 0 0 0 0 0 0 0 0 0 0 0 0 5.0640 -4.2830 6.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 -2.9140 6.1180 C 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 1.1610 1.2140 2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 -3.7270 2.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -4.4720 0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 -4.4900 1.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3110 -4.6380 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6770 2.3400 6.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8390 -1.2360 7.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2890 -0.7440 8.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4340 -2.3810 10.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9380 -3.0880 9.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6440 -4.9560 6.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0690 -4.6970 6.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4760 -3.0330 5.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9410 -2.4860 5.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 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 23 24 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 M END