IBS-ZINC06659667 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 0 0 0 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 1.1990 -0.6920 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 0.0100 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4150 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 2.0970 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6670 2.1290 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7070 3.3440 -0.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8030 1.3980 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7680 0.0560 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8200 -0.5530 -0.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -0.6420 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6480 -1.6120 -0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0980 2.0830 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5620 2.3140 1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8940 3.0190 1.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4200 3.3080 0.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5000 3.3280 2.5510 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7240 3.9760 2.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4070 4.3480 1.4220 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1260 4.2080 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5750 4.9630 1.8370 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6480 5.5380 1.1730 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6900 6.0830 1.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6710 6.0600 3.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6140 5.4930 3.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5510 4.9370 3.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3950 4.3270 3.6100 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5520 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -1.7720 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 3.1760 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8300 1.4690 -0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9980 3.0420 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8290 2.9280 1.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6610 1.3550 1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0790 3.0970 3.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6690 5.5590 0.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5250 6.5310 1.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4930 6.4910 3.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6070 5.4790 5.0380 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 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 32 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 14 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 28 2 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 26 2 0 0 0 0 25 40 1 0 0 0 0 26 27 1 0 0 0 0 26 41 1 0 0 0 0 27 28 1 0 0 0 0 M END