MMs03127575 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 1.3025 0.7440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9005 0.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0238 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4986 0.7203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5054 2.2202 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0357 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.9456 -0.8842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9441 -1.5282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4099 -1.8468 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.1658 -0.5512 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.7658 -1.5904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1672 0.5681 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4858 2.0339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9145 2.4909 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3757 3.0427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6943 4.5085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5842 5.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1555 5.0603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8369 3.5945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9470 2.5857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0454 6.0691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6583 -0.4012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2747 0.9663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7672 1.1163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6433 -0.1013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0269 -1.4688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5344 -1.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1358 0.0487 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.5952 1.0420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 -0.5952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5952 -1.0420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5353 1.6668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 1.6598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8225 -0.9276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3652 -0.9347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1334 1.6549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6761 1.6479 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1906 -1.2238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7441 -1.5227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8132 -2.7210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8373 4.8741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8391 6.6899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6940 3.2289 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6922 1.4131 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8524 6.9572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1573 6.8761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2384 5.1810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5738 1.9404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2603 2.2103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7278 -2.4428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0413 -2.7128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 24 1 0 0 0 0 14 15 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 22 2 0 0 0 0 18 19 2 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 M END