MAYBRIDGE-ZINC01037467 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 -0.0230 1.8080 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0020 -0.0040 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 -0.3320 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 -1.5830 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7420 -1.5540 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2580 -0.3140 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9850 0.8940 0.0410 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.6230 -0.0250 0.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0400 1.2570 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2300 2.1590 0.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3550 1.5380 -0.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3610 0.4650 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4260 0.8010 1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9120 2.1260 0.8040 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9180 3.1450 0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8270 2.9290 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5760 -2.7780 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5380 -3.6540 1.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3170 -4.7920 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1360 -5.0660 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1780 -4.2000 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4070 -3.0560 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1140 -6.5000 0.0080 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -2.7920 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 -3.7520 -0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 2.1850 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5500 2.1710 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 2.1560 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2710 -0.7460 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8250 0.3950 -1.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8860 -0.4840 0.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2510 0.0930 0.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9870 0.7420 2.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3770 4.1230 0.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4760 3.0940 1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9980 3.6120 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2370 3.1120 -1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8990 -3.4410 1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2880 -5.4710 1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8190 -4.4190 -1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4440 -2.3790 -1.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 5 6 2 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 24 25 3 0 0 0 0 M END