MMs00170165 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 1.3027 -0.7436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3101 -2.2436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0147 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0221 -4.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3248 -5.2436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6201 -4.4872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6128 -2.9872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9081 -2.2309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9007 -0.7309 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2108 -2.9745 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5061 -2.2181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4988 -0.7182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0968 -0.7054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1042 -2.2054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8088 -2.9618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 0.0509 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.6358 1.3463 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1485 -1.2444 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6875 0.8073 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 0.0637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2856 0.8200 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.5883 0.0764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5956 -1.4236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3003 -2.1799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9976 -1.4363 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5949 1.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0422 0.5949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5949 -1.0422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0275 -2.4051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0142 -5.1050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3306 -6.4436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6623 -5.0821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2167 -4.1745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4566 -0.1233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7883 1.2382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1463 -2.8003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8147 -4.1617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6816 2.0073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6245 0.6815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6378 -2.0185 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3062 -3.3799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 M END