CHEMDIV-ZINC02970965 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 0 0 0 0 0 0999 V2000 -0.0490 1.8340 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 0.5130 -0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9770 -0.2580 -0.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2490 0.2820 -0.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3540 1.6030 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 2.3840 0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7010 2.1530 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8110 3.3310 0.4250 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7730 1.2790 -0.1170 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5440 -0.0140 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3710 -0.5170 -0.7850 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9190 -1.0480 -0.9250 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4960 -2.4570 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6880 -3.3940 0.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6350 -3.1870 0.9710 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6140 -4.4810 -0.6380 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6600 -5.4950 -0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5360 -6.5350 0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5150 -7.6770 0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8190 -7.5750 0.7740 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7200 -8.6370 0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3160 -9.8070 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0310 -9.9220 -0.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1350 -8.8560 -0.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4870 -11.1800 -0.1780 S 0 0 0 0 0 0 0 0 0 0 0 0 11.0260 -11.8350 -1.4010 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7690 -10.4930 -0.3040 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3340 -12.0650 1.1370 N 0 5 0 0 0 0 0 0 0 0 0 0 10.4010 -12.4250 1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1100 1.8140 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5260 1.3960 1.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4490 0.4880 2.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3720 0.5460 3.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4180 1.4900 3.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8980 2.0110 2.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 2.4350 0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 0.0800 -0.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8780 -1.2870 -1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3060 3.4150 0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2620 -2.1170 1.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6210 -2.9810 -0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8130 -4.5880 -1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5730 -5.9710 -1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6350 -4.9970 -0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6810 -6.0590 1.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5140 -6.9350 0.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1390 -6.6700 1.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7260 -8.5530 1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7260 -10.8320 -1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1340 -8.9580 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8330 1.4690 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1100 2.9080 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0930 -0.1470 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9440 -0.0300 4.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0130 1.8860 4.6500 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 36 1 0 0 0 0 2 3 2 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 38 1 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 18 46 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 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 28 29 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 31 32 2 0 0 0 0 31 35 1 0 0 0 0 32 33 1 0 0 0 0 32 53 1 0 0 0 0 33 34 2 0 0 0 0 33 54 1 0 0 0 0 34 35 1 0 0 0 0 34 55 1 0 0 0 0 M CHG 1 28 -1 M END