MMs02042981 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 49 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 1.2952 -0.7566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2877 -2.2565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8933 -0.7697 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2037 1.4737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4913 -0.7828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4837 -2.2828 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0394 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0894 -0.7959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3922 -0.0525 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5436 0.7960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7594 -0.6695 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7687 0.4401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0253 1.7429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5565 1.4385 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0638 -2.1383 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.5326 -1.8339 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5951 -2.4428 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3683 -3.6071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7925 -4.0778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0970 -5.5466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9772 -6.5446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5530 -6.0739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2485 -4.6051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2816 -8.0134 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6052 1.0362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0362 0.6052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6052 -1.0362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2560 -1.3566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0877 -2.2505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2816 -3.4565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4876 -2.2626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8314 0.9100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3740 0.9022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8872 -1.9697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8002 1.1606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3134 -1.7113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8561 -1.7191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5671 -0.4557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7431 1.1405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1240 2.2254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6602 2.8860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6883 -3.2794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2363 -5.9232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6571 -6.8724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1091 -4.2286 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 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 17 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 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 26 2 0 0 0 0 22 23 2 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 M END