MMs00985396 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 -0.6597 -1.3471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1771 -2.5920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4826 -3.9392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9792 -4.0414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8159 -2.7965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1562 -1.4494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9930 -0.2045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4920 -0.1497 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9032 1.2928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6583 2.1296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4777 1.2042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6035 3.6286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3119 1.8081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4625 0.8458 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.2044 -0.6318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8712 1.3611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0218 0.3987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7637 -1.0789 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.4305 0.9140 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.5811 -0.0483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9899 0.4670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.8824 -1.9730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.0330 -2.9353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.4417 -2.4200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -17.6998 -0.9424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.5492 0.0199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0777 -0.5278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5278 1.0777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0777 0.5278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3743 -2.5102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1868 -4.9351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5069 -5.1191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0132 -2.8783 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4043 3.5848 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5597 4.8278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8027 3.6724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7102 2.8464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2299 2.5809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2695 2.3993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7892 2.1339 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6370 2.0961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6631 -0.8211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1828 -1.0866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3882 1.5052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.9079 1.2398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2840 -3.0132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7541 -1.5644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1150 -3.7081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.6346 -3.9736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.8281 -1.3510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.2981 0.0978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -17.4672 0.7928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.9475 1.0582 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1405 -0.4954 0.0000 N 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 35 1 0 0 0 0 13 36 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 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 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 21 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 55 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 55 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 M END