IBS-ZINC05455111 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6190 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1420 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 -0.4730 3.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9020 -1.8670 3.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -2.6360 2.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -2.0070 1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -2.7490 0.1120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 -3.0890 -1.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 -3.9930 2.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3020 -4.6600 2.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5810 -2.5270 4.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6360 -3.8230 4.3560 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2810 -4.4500 5.4300 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3400 -5.8260 5.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9400 -6.5440 6.4860 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3930 -6.1820 7.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7800 -7.8850 6.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1650 -9.0650 6.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8440 -10.2780 6.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1400 -10.3250 5.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7500 -9.1630 4.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0660 -7.9270 4.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8230 -6.6420 4.6040 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 1.2200 2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 0.1240 3.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2690 -2.1780 -1.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7770 -3.6700 -0.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 -3.6800 -1.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 -4.3270 3.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 -4.4250 2.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 -5.7370 2.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 -1.9330 5.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 -3.9160 6.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 -9.0350 7.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1450 -11.1960 6.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8950 -11.2800 4.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2020 -9.2080 3.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 2 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 25 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 M END