MMs01336831 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 40 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 1.3053 0.7390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5854 -1.5218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8780 -2.2827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1833 -1.5437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9033 0.7172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4760 -2.3046 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7813 -1.5656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0740 -2.3265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0614 -3.8264 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3793 -1.5875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6720 -2.3484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9773 -1.6093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9899 -0.1094 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2700 -2.3702 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.5753 -1.6312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8680 -2.3921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1733 -1.6531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1859 -0.1531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8932 0.6078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5879 -0.1313 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.4912 0.5859 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 16.8553 -3.8921 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5912 1.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0442 -0.5912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5912 -1.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5411 -2.1131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8679 -3.4827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2402 0.5475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9134 1.9171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0177 -0.6399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5604 -0.6529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8929 -3.2611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4356 -3.2741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2599 -3.5702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2074 -2.2618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9033 1.8077 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 9 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 M END