CHEMBRIDGE-ZINC00182258 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -0.0790 1.1930 0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -0.1480 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3680 -0.6790 -0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 0.1300 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2950 1.4700 0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0220 2.0010 0.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8570 -0.4500 -0.2050 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7930 -1.5220 -0.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6090 0.2070 -1.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4000 1.0960 -1.0990 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -0.1940 -2.6040 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1340 0.4440 -3.7010 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1320 0.7150 -3.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2500 -0.5380 -4.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4540 0.3030 -6.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5100 1.8270 -5.8350 S 0 0 0 0 0 0 0 0 0 0 0 0 4.4020 1.6880 -4.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 2.4630 -3.3890 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7310 -0.1520 1.3570 S 0 0 0 0 0 0 0 0 0 0 0 0 6.2020 -1.1060 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2020 -1.0320 2.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3530 -1.7810 1.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5120 -2.6020 0.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5180 -2.6780 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3620 -1.9370 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 1.6090 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 -0.7790 -0.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5040 -1.7260 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1550 2.1020 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8860 3.0480 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7700 -0.9050 -2.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1050 -1.1970 -4.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3360 -1.1260 -4.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5100 0.5310 -6.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0570 -0.2220 -7.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0790 -0.3900 2.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1310 -1.7240 2.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4130 -3.1860 0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6460 -3.3210 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5840 -2.0000 -0.6730 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 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 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 19 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 M END