MAYBRIDGE-ZINC00119314 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 -0.0220 1.4240 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 -0.0050 -0.1360 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 -0.6340 -0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 0.0150 -0.0760 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 -2.0440 -0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4020 -2.7920 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1980 -4.1490 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 -4.5310 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -3.1110 -0.0610 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4100 -5.9210 0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8960 -6.3080 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 -7.6710 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 -8.4020 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 -7.3470 0.1130 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.6740 -2.2190 0.0260 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7680 -3.0020 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6500 -4.2090 -0.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1360 -2.3770 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1930 -3.4780 -0.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5610 -2.8530 -0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6780 -1.6510 -0.3520 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 1.8010 -0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 1.7550 -1.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 1.8040 0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0100 -4.8600 0.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7140 -5.6040 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0700 -8.1180 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -9.4810 0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7720 -1.2580 0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3220 -1.7710 0.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1850 -1.7460 -1.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0070 -4.0840 -1.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1440 -4.1090 0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6500 -3.6330 -0.4560 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5060 -3.1860 -0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 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 15 1 0 0 0 0 7 8 2 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 10 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 26 1 0 0 0 0 12 13 2 0 0 0 0 12 27 1 0 0 0 0 13 14 1 0 0 0 0 13 28 1 0 0 0 0 15 16 1 0 0 0 0 15 29 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 30 1 0 0 0 0 18 31 1 0 0 0 0 19 20 1 0 0 0 0 19 32 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 20 34 1 0 0 0 0 34 35 1 0 0 0 0 M END