CHEMBRIDGE-ZINC02997912 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 0.0310 2.5030 1.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2540 1.0130 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 0.2960 2.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -1.0900 2.0490 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 -1.9200 2.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -3.2660 2.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 -4.2200 3.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4190 -3.8330 4.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8120 -2.4910 4.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 -1.5380 3.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1020 -4.8820 5.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1420 -6.0210 4.7750 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5920 -4.4580 6.4620 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3820 -5.1220 7.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9020 -6.7050 7.3130 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6420 -4.2200 8.4680 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2940 -4.2540 9.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8630 -5.3870 10.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4840 -5.3060 11.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5390 -4.0960 12.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9700 -2.9560 11.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3410 -3.0150 10.4250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7200 -1.7590 9.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1460 -1.9090 8.6930 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0520 2.6920 0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 2.9900 0.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 2.9700 2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2910 0.8460 1.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 0.5720 0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 0.4290 1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 0.7100 3.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -3.5730 2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -5.2620 3.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 -2.1580 5.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 -0.5070 3.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3450 -3.5120 6.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2900 -3.2470 8.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8430 -6.3560 9.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9230 -6.1980 12.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0220 -4.0380 13.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0120 -2.0110 12.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8110 -0.6770 10.4880 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 36 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 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 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 42 2 0 0 0 0 M CHG 1 24 -1 M END