CHEMDIV-ZINC01098811 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.0220 1.8100 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 -0.4240 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0990 -1.7580 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4410 -2.0830 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3970 -1.0830 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0120 0.2460 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6720 0.5780 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8600 -1.4420 0.0490 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2250 -1.5240 -0.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0470 -2.7160 0.7390 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8700 -2.8770 2.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6160 -4.1530 2.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4540 -4.3480 3.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5430 -3.2790 4.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7890 -2.0090 4.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9430 -1.8090 2.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2170 -0.1780 2.3710 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.9610 0.4850 2.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3780 0.3200 3.0220 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6210 -0.3970 0.7640 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6640 0.3930 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9690 -0.3600 0.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8310 -0.1840 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0280 -0.8740 1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3620 -1.7410 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5000 -1.9170 -0.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3060 -1.2230 -0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1870 0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1610 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -2.5390 0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7450 -3.1190 0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7610 1.0240 0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3720 1.6160 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3070 -3.4890 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5470 -4.9920 1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2560 -5.3390 4.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4220 -3.4370 5.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8600 -1.1730 5.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7770 1.3470 0.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3840 0.5710 -0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5700 0.4940 2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7020 -0.7370 2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2970 -2.2820 0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7620 -2.5940 -1.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6340 -1.3570 -1.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 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 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 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 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 21 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 M END