MMs03882973 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 1.5000 -0.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2406 -1.3152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4812 -2.6088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0187 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7594 -1.2936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4926 -4.0212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7146 -4.9116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9344 -4.0387 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0730 -4.4178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9224 -4.4744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2449 -5.9394 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5555 -7.0985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1375 -6.9511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4599 -8.4160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6748 -6.3926 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7822 -5.3809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4598 -3.9159 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2121 -5.8341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5346 -7.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9645 -7.7522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0719 -6.7405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7495 -5.2756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3196 -4.8224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9971 -3.3574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5672 -2.9042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1046 -2.3457 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5925 1.0435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1074 1.0240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4405 -1.3239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9593 -1.2849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7059 -6.1116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0809 -3.2849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1214 -4.4239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9327 -7.5645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6486 -8.1084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2224 -8.9242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2158 -7.1031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6354 -4.4662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8466 -1.1738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2485 -2.7083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2924 -6.4979 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1784 -7.3072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 19 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 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 42 43 1 0 0 0 0 M END