MMs01688123 MOE2007 2D CORINA 3.40 0006 02.08.2006 34 35 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 1.2998 -0.7486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8979 -0.7459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0055 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4960 -0.7431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4976 -2.2431 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 0.0082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0941 -0.7404 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 0.0110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5475 1.5029 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0144 1.8164 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7658 0.5181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7633 -0.5977 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2577 0.3629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0091 -0.9353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4760 -0.6219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6312 0.8700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2602 1.4787 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5989 1.0399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0399 0.5989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5989 -1.0399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5295 -1.6687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0721 -1.6671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8258 0.9212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3684 0.9228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1275 -1.6659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6702 -1.6643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1949 1.2055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0219 0.9267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5646 0.9283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5222 -2.0321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3686 -1.4239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6698 1.4711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 14 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 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 M END