IBS-ZINC05455010 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 37 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3830 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 1.1980 -0.6870 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4020 0.0230 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4270 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 2.0980 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 1.8360 -0.0230 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0190 2.7520 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4720 0.7090 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7060 -0.3540 -0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8510 0.6930 -0.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5370 -0.5280 -0.0620 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8360 -0.5430 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5580 -1.8280 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8340 -3.0360 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4770 -4.2310 -0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8840 -4.2750 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6250 -3.0640 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9440 -1.8380 -0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9630 -3.1080 -0.1260 N 0 0 0 0 0 0 0 0 0 0 0 0 12.5760 -4.2700 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8470 -5.4600 -0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5330 -5.4440 -0.1240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -0.5530 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -1.7670 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 3.1780 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3460 1.5280 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3860 0.3860 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7550 -3.0120 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9090 -5.1490 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4950 -0.9090 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6560 -4.3040 -0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3690 -6.4060 -0.1440 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 1 0 0 0 0 11 28 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 23 2 0 0 0 0 18 19 1 0 0 0 0 18 20 2 0 0 0 0 19 32 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 33 1 0 0 0 0 22 23 1 0 0 0 0 22 34 1 0 0 0 0 M END