CHEMBRIDGE-ZINC02877287 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.7500 2.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7030 -1.2080 3.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -1.4200 3.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7640 -1.1740 2.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0950 -0.7200 1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7970 -1.9180 4.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8170 -3.4250 4.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 -4.1930 4.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5500 -5.4910 4.2510 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 -5.8550 4.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6070 -4.4790 5.4040 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 -7.1710 5.1130 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8670 -8.1820 4.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8930 -7.9430 4.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 -9.5830 4.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2560 -10.6330 4.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8720 -11.9380 4.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7030 -12.2070 5.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 -11.1710 5.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2870 -9.8610 5.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 -0.5840 2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -1.3990 4.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8310 -1.3390 2.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -0.5320 0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8200 -1.5410 4.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 -1.5650 5.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6180 -3.7870 3.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 -7.3620 5.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1680 -10.4240 3.9020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4840 -12.7510 4.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 -13.2300 5.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -11.3870 6.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6710 -9.0530 5.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 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 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 M END