MMs02601698 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 0 0 1 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 0.8392 -1.2433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3355 -1.1382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3001 -2.2869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6906 -1.7246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5855 -0.2283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1300 0.1342 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.8288 0.6109 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1772 -0.0462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2823 -1.5425 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0390 -2.3817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1442 -3.8780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6307 -2.1996 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.6700 -2.7996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7359 -3.6959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8740 -1.3604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7689 0.1359 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2224 -2.0176 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4657 -1.1784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3606 0.3179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6039 1.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9523 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0574 -0.9963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8141 -1.8355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9192 -3.3318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4058 -1.6534 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9946 0.6714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6714 0.9946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9946 -0.6714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2569 -1.7317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1299 -2.4075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0101 -3.4514 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1719 0.6252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5388 -3.7800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8199 -4.8930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9329 -3.6119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3065 -3.2146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2819 0.8436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5198 2.3542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9469 1.1713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7222 -3.4159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0033 -4.5289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1163 -3.2477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 34 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 24 2 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 M END