IBS-ZINC00507674 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3820 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 1.2180 -0.6610 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 0.0150 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 1.3340 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1930 2.0590 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 2.0580 -0.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 3.5180 3.1300 0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5470 1.5720 1.1500 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0700 1.8520 2.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9130 2.2050 1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4020 2.9110 2.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6590 3.4900 2.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3800 3.3350 0.8970 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8270 2.6140 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6290 2.0730 -0.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6770 0.1500 1.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3720 1.7950 -1.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 1.9230 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 -0.5640 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2410 -1.7410 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 3.1390 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8110 3.0120 3.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0660 4.0480 2.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3630 3.7720 0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3820 2.4890 -1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0940 -0.1710 0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5590 0.8580 -1.4030 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 19 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 21 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 18 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 17 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 23 1 0 0 0 0 13 14 1 0 0 0 0 13 24 1 0 0 0 0 14 15 2 0 0 0 0 14 25 1 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 17 27 1 0 0 0 0 18 28 1 0 0 0 0 M END