CHEMBRIDGE-ZINC02880810 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 38 0 0 0 0 0 0 0 0999 V2000 -0.0210 1.4180 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 0.0310 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 -0.6460 0.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 0.0620 0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 1.4620 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 2.1270 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6230 1.9900 0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6270 1.1780 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0660 -0.4880 -0.0130 S 0 0 0 0 0 0 0 0 0 0 0 0 6.0460 1.5910 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0550 0.6260 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3770 1.0150 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7060 2.3660 -0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7040 3.3290 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3800 2.9470 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0470 2.7560 -0.0780 N 0 0 0 0 0 0 0 0 0 0 0 0 10.4170 3.8670 -0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5760 4.5730 -1.2600 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8760 4.2320 -0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2310 5.5050 -1.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5290 4.1330 -2.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 1.9420 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 -0.5190 0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2020 -1.7250 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 3.2060 0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8000 -0.4230 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1580 0.2690 -0.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9630 4.3770 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6020 3.6960 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7120 2.2270 0.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4880 3.9800 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4100 6.0780 -2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0770 6.0910 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5720 3.8170 -2.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9050 3.8050 -3.0620 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 9 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 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 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 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 31 1 0 0 0 0 20 21 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 M END