CHEMBRIDGE-ZINC01099936 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2030 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 0.0350 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4330 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0950 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 -0.6800 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 -1.8920 -0.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9840 0.0960 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1630 -0.8790 -0.0590 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0750 -1.5690 0.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4530 -0.1090 0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7850 0.8320 -0.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9680 1.5380 -0.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8190 1.3050 0.2690 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4870 0.3650 1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3020 -0.3390 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4000 0.1150 2.3660 N 0 3 0 0 0 0 0 0 0 0 0 0 11.4420 0.7370 2.4580 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1070 -0.7140 3.2090 O 0 5 0 0 0 0 0 0 0 0 0 0 6.1540 -1.8140 -1.6130 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4680 -2.9670 -1.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8510 -3.8880 -2.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9110 -4.6840 -1.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3880 -4.4140 -0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4830 -3.0840 0.0420 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5550 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -1.7610 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 1.9930 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 3.1750 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0230 0.7270 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0390 0.7190 0.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1190 1.0140 -1.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2270 2.2730 -1.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7440 1.8560 0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0410 -1.0700 1.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3700 -4.0010 -3.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3210 -5.4640 -2.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2080 -4.9310 -0.1950 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 21 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 34 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 25 40 1 0 0 0 0 M CHG 1 18 1 M CHG 1 20 -1 M END