CHEMBRIDGE-ZINC04998323 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 0.0080 1.5310 0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 0.0020 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -0.4780 1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 -2.0070 1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5240 -2.4620 -0.0430 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -2.0540 -1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 -0.5260 -1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -3.8480 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6480 -4.7020 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -6.0680 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1090 -6.5900 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1800 -5.7360 -0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9850 -4.3690 -0.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1260 -3.4590 -0.5300 N 0 3 0 0 0 0 0 0 0 0 0 0 5.2360 -3.9170 -0.7370 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9550 -2.2540 -0.5280 O 0 5 0 0 0 0 0 0 0 0 0 0 2.3050 -7.9770 -0.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4680 -8.4930 0.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3100 -7.7640 0.8800 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 -9.9330 0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8550 -10.5730 0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8260 -11.9290 0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 -12.3860 -0.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6070 -11.1140 -0.3960 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 1.9050 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 1.8720 -0.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 1.9060 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 -0.3740 0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 -0.0700 1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -0.1420 2.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 -2.3520 2.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -2.4150 1.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0300 -2.4320 -2.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 -2.4610 -0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -0.2240 -2.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5570 -0.1190 -1.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3370 -4.2960 0.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -6.7320 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1650 -6.1420 -0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 -8.5650 -0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6920 -10.0640 1.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6460 -12.5780 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 -13.4220 -0.3480 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 2 7 1 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 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 37 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END