CHEMDIV-ZINC01275150 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 59 0 0 0 0 0 0 0 0999 V2000 0.1530 0.9920 -1.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 1.1390 0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 1.1880 1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4530 1.0880 0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 0.9430 -0.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 0.8900 -1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8690 0.8790 -1.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2770 0.7730 -2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5440 0.9850 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 1.1120 1.0730 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0280 0.9680 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7880 1.3120 1.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0590 1.1650 3.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8420 -0.2040 3.9090 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6760 -0.9570 3.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4070 -0.7680 1.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6080 -0.6530 4.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3170 -1.8810 5.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6230 -2.9350 4.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3580 -3.9570 4.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7160 -3.6640 6.2800 S 0 0 0 0 0 0 0 0 0 0 0 0 9.9230 -2.1670 6.2320 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9480 -1.4060 7.3360 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3170 -0.2480 7.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6750 0.1650 6.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8760 -5.1770 3.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2250 -5.3310 2.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1340 -3.9870 1.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2630 -2.9880 2.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 0.9580 -1.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9340 1.2160 0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 1.3030 2.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 0.7770 -2.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4900 0.2040 -0.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4150 1.9530 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7620 2.3700 1.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5440 0.7910 1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0890 1.4910 3.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3940 1.8360 4.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7590 -2.0260 3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8050 -0.5980 4.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1660 -1.2670 1.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4180 -1.1570 1.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3170 0.4390 7.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9620 -5.0790 3.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6910 -6.0800 4.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7990 -6.0480 1.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2150 -5.7460 2.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1430 -3.5760 1.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7150 -4.1340 0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2160 -3.2980 2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3670 -1.9970 2.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4470 0.7060 1.5950 N 0 3 0 0 0 0 0 0 0 0 0 0 5.7110 1.1690 2.1560 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 11 53 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 25 2 0 0 0 0 18 19 1 0 0 0 0 18 22 2 0 0 0 0 19 20 2 0 0 0 0 19 29 1 0 0 0 0 20 21 1 0 0 0 0 20 26 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 53 1 M END