IBS-ZINC00546887 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3580 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 1.2230 -0.6890 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4290 0.0350 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 1.4190 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1810 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1460 3.5610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1850 4.1940 0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 4.2070 0.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0690 5.6080 0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 6.2300 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 7.7040 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4620 8.3960 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4470 9.7740 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 10.4400 0.0700 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 9.8290 0.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 8.4520 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4390 -0.9080 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3930 -0.7290 -0.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8490 -2.1310 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5530 -2.0040 -0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.8810 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3290 1.9780 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 3.7020 0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1310 5.6680 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3980 7.8570 0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3810 10.3170 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 10.4150 0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9020 7.9590 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3770 -3.0730 -0.0460 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 22 1 0 0 0 0 2 3 2 0 0 0 0 2 23 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 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 24 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 25 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 31 1 0 0 0 0 M END