CHEMBRIDGE-ZINC04702286 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 0 0 0 0 0 0999 V2000 0.0490 1.5020 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 -0.0050 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -0.6980 0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -2.0790 0.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -2.7720 -0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 -2.0730 -0.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8400 -0.6920 -0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8060 0.0680 -1.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -4.1700 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -4.8480 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -4.0040 2.6260 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3000 -6.1900 1.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 -6.9600 2.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5450 -7.8870 2.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 -8.6960 1.1270 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 -7.8520 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 -6.9250 -0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5190 -9.6620 1.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6580 -10.5320 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6570 -11.4880 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4860 -11.5430 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2910 -10.6480 2.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 1.8680 -0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 1.8670 -0.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 1.8620 0.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6240 -0.1580 1.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6260 -2.6190 1.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -2.6090 -1.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 0.2530 -2.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7160 -0.5190 -1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 1.0180 -1.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 -4.6530 -0.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -6.2780 3.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5850 -7.5550 2.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 -7.2890 2.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 -8.5430 3.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5360 -7.2550 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6590 -8.4840 -0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 -7.5160 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -6.2200 -0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9950 -10.4620 -0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7890 -12.1770 -0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2750 -12.2780 1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9330 -10.6870 3.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3330 -9.7420 2.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 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 12 17 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 45 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 M END