MMs01128459 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 57 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 0.1418 -1.4933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 -2.1171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6478 -3.6104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4255 -4.4798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0120 -4.2342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3091 -5.7044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7993 -5.8762 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.4231 -4.5120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3184 -3.4972 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8933 -4.2149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8858 -5.3396 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4080 -6.7614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4005 -7.8862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9227 -9.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4524 -9.6052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4599 -8.4805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9377 -7.0586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3561 -5.0424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3486 -6.1671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8339 -3.6206 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3041 -3.3234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2966 -4.4481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7669 -4.1510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2447 -2.7291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2522 -1.6044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7819 -1.9015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7150 -2.4319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1946 0.1135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1135 1.1946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1946 -0.1135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0543 -1.3976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1601 -2.6547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4973 -6.5881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4550 -3.0978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9173 -3.5892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6080 -6.7614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1487 -6.9480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4543 -8.4601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1093 -9.4869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9526 -10.5077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8908 -10.7223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4285 -10.2309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7117 -9.4186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4061 -7.9065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9079 -5.8590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7512 -6.8797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0399 -2.7208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9144 -5.5856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5609 -5.0507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6344 -0.4669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9879 -1.0018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9527 -3.6082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8912 -2.1942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4772 -1.2557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 10 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 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 48 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 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 M END