CHEMBRIDGE-ZINC04845861 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 42 0 0 0 0 0 0 0 0999 V2000 0.1530 1.4320 1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 2.0400 1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5450 1.3600 1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 0.0580 0.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -0.5490 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 0.1400 0.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7350 -0.6770 0.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9050 -1.9700 0.1760 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0180 -2.3280 -0.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8680 -1.3110 -0.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0460 -1.3780 -0.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0530 -0.0970 -0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4230 1.2390 -0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7680 1.5780 -0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2720 2.8660 -0.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6470 2.7420 -0.8030 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9390 1.3930 -0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7990 0.7110 -0.5730 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2810 0.8000 -0.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0970 1.1800 -1.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3500 0.6210 -2.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8000 -0.3140 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9970 -0.6950 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7440 -0.1400 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8900 -0.5440 1.1350 N 0 3 0 0 0 0 0 0 0 0 0 0 10.2960 -1.3630 1.9400 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7820 -0.0560 1.2680 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.7560 1.9660 1.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4240 3.0480 1.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5020 1.8360 1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -1.5580 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8720 -0.3300 0.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6740 2.0140 -0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7060 3.7850 -0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3510 3.5480 -0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7460 1.9080 -2.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9810 0.9130 -2.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7820 -0.7480 -1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3550 -1.4250 0.5500 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 28 1 0 0 0 0 2 3 2 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 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END