MMs01118967 MOE2007 2D CORINA 3.40 0006 02.08.2006 36 38 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 1.4979 -0.0799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1776 -1.4170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3160 1.1774 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8140 1.2545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2035 2.7031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9463 3.5212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7797 2.5783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3798 3.1171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1465 4.5988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3131 5.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7130 5.0029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6044 3.2393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7693 2.2943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2185 2.6812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7573 4.0811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0343 1.4225 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0893 0.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4762 -1.1916 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.6894 0.7964 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.5322 1.3426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2120 0.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7098 -0.0744 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0639 1.1983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1983 0.0639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0639 -1.1983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5683 0.3213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5534 2.3627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9734 5.0299 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1265 6.7271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6462 5.7572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 4.4244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3870 2.5338 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6801 1.6924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3938 -1.2518 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9377 -2.3215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 11 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 20 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 21 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 21 22 1 0 0 0 0 21 33 1 0 0 0 0 21 34 1 0 0 0 0 22 23 2 0 0 0 0 22 35 1 0 0 0 0 35 36 1 0 0 0 0 M END