CHEMBRIDGE-ZINC00493856 MOE2007 3D CORINA 3.40 0006 02.08.2006 32 35 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3840 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 1.1850 -0.6850 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 0.0190 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3760 1.4260 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 2.0990 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6950 1.8290 -0.0240 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0190 2.7430 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4620 0.6940 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6880 -0.3630 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9400 0.6670 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6130 1.7840 -0.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0290 1.7580 -0.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6560 -0.6270 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0170 -0.7750 -0.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6740 -0.0620 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2770 -2.1300 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4400 -2.8880 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3590 -4.2640 -0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1230 -4.8960 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9680 -4.1690 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0240 -2.7700 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0830 -1.8050 -0.0600 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5510 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1880 -1.7650 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 3.1790 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4390 2.6330 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4050 -2.4020 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2630 -4.8550 -0.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0750 -5.9750 -0.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0120 -4.6710 -0.0820 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 23 2 0 0 0 0 15 16 1 0 0 0 0 15 17 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 29 1 0 0 0 0 19 20 1 0 0 0 0 19 30 1 0 0 0 0 20 21 2 0 0 0 0 20 31 1 0 0 0 0 21 22 1 0 0 0 0 21 32 1 0 0 0 0 22 23 1 0 0 0 0 M END