CHEMBRIDGE-ZINC01127781 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 0 0 0 0 0999 V2000 -0.0720 1.3500 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.0260 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 -0.6850 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3740 0.0420 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 1.4180 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 2.0840 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 3.5600 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 4.1380 0.1330 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 4.2660 -0.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1800 5.7310 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6050 6.2810 -0.0790 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0790 5.9370 -0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5740 7.8220 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4340 8.1960 1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2840 6.9160 1.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 5.8450 1.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 -2.0410 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -2.6790 -1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2980 -1.9480 -2.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 -2.5990 -3.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3210 -3.9780 -3.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0960 -4.7100 -2.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -4.0640 -1.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -4.9840 0.2560 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -4.6720 -4.5000 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2460 -4.0280 -5.4670 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 -5.8870 -4.5080 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.0210 1.8610 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9460 -0.5940 0.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3210 -0.4730 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2600 1.9830 -0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0720 3.8050 -0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 6.0900 -0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7160 6.0690 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0130 8.2290 -0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5520 8.1800 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0700 9.0540 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8060 8.3890 2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1370 6.9080 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6150 6.8360 2.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 -0.8710 -2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -2.0300 -4.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -5.7870 -2.2290 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 17 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 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 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 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