MMs01694877 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 1.3052 0.7392 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2660 1.3392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3177 2.2391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0785 3.5318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5786 3.5443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0216 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5855 -1.5216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2802 -2.2607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -2.9999 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.5411 -0.9555 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0194 -3.5660 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.9032 0.7175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9157 2.2175 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5012 0.6959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7815 -1.5649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0742 -2.3257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3794 -1.5865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3919 -0.0866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0992 0.6742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1117 2.1742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4169 2.9133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8190 2.9350 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8290 4.1349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5137 2.1958 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5913 1.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0442 -0.5913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2957 -0.5221 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1586 2.5497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2027 3.1120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2968 4.7118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5524 3.1433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3801 4.7278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7690 -1.3231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9865 -2.6526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4170 -0.9561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9596 -0.9689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7373 -2.1562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0642 -3.5256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4136 -2.1952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4361 0.5047 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 2 4 1 0 0 0 0 2 7 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 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 5 33 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 13 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 27 2 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 M END