MMs00430967 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 44 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 1.4378 -0.4276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5269 0.6038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7864 -1.8865 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1716 -2.4620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0522 -3.9573 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5933 -4.3059 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -3.0261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6843 -2.9068 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5352 -4.1420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4514 -1.6797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7688 -2.3968 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0486 -1.6145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0110 -0.1149 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3661 -2.3316 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6459 -1.5493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6082 -0.0498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8880 0.7326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2055 0.0154 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2431 -1.4841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9633 -2.2664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5606 -2.2012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2778 -0.8838 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.8434 -3.5187 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 14.8780 -2.9184 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 13.4853 0.7978 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.3421 1.1502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1502 0.3421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3421 -1.1502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1272 0.7315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3520 -0.2676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3983 1.4289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7019 1.4751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5235 -3.4613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2160 -5.1302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 -4.8228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6572 -0.7801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1994 -0.7414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7989 -3.5965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3962 -3.5313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5543 0.5240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8579 1.9322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9934 -3.4661 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 4 1 0 0 0 0 2 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 8 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 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 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 40 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 26 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 M END