MMs01282854 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 0 0 0 0 0 0 0 0999 V2000 0.0000 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4999 -0.0130 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2612 1.2795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5224 2.5850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2837 3.8775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7836 3.8645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5223 2.5590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7611 1.2665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 -0.0390 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8779 -1.4039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9839 -2.4172 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2894 -1.6785 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9902 -0.2087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0035 0.8973 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.4680 0.5728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4813 1.6788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0301 3.1093 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9458 1.3542 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9591 2.4602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4235 2.1356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4368 3.2416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9857 4.6722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5212 4.9967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5079 3.8907 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.9990 5.7781 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0104 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0104 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3225 2.5954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6927 4.9219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3926 4.8985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7223 2.5486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7020 -1.6433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0088 -0.5359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4801 -0.0719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3067 0.2098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7845 0.9912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6084 2.9820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1603 6.1412 0.0000 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 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 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 36 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 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 M END