CHEMBRIDGE-ZINC00290811 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3840 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 1.1860 -0.6850 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0190 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 1.4260 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 2.0990 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 1.8310 -0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0190 2.7460 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4650 0.6950 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6880 -0.3640 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9330 0.6670 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5620 -0.4710 -0.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9620 -0.4970 -0.0810 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6140 -1.6770 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9870 -2.7180 -0.0920 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0920 -1.7040 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7810 -2.9240 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1640 -2.8950 -0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8160 -1.6740 -0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1400 -0.5410 -0.1260 N 0 0 0 0 0 0 0 0 0 0 0 0 10.8240 -0.5160 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5510 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -1.7650 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 3.1790 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4910 1.5920 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4630 0.3340 -0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2460 -3.8620 -0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7290 -3.8150 -0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8950 -1.6490 -0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3060 0.4320 -0.1110 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 1 0 0 0 0 3 4 1 0 0 0 0 3 24 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 28 1 0 0 0 0 18 19 1 0 0 0 0 18 29 1 0 0 0 0 19 20 2 0 0 0 0 19 30 1 0 0 0 0 20 21 1 0 0 0 0 21 31 1 0 0 0 0 M END