MMs03684702 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 52 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 0.0123 -1.4999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2805 -2.2606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3175 -2.2392 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6103 -1.4786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0214 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9155 -2.2179 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2083 -1.4572 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2083 -2.6572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3528 0.0358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8174 0.3597 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.9689 1.2082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5781 -0.9331 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5836 -2.0561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0711 -1.0777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9428 0.1431 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6925 -2.4429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1855 -2.5875 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.8068 -3.9527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4163 1.7350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9067 1.9040 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5246 2.9412 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0342 2.7722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1235 4.3165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2318 5.5227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8307 6.8980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7414 5.3537 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0099 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0269 -0.8999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8890 -1.2263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3148 -2.8691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 -3.2949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3273 -3.4392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9253 -3.4179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1529 0.0259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2852 0.6320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9922 -3.1002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5602 -2.7534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5305 -2.7428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7860 -3.6393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7146 -4.4498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3039 -5.0449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8990 -3.4556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8990 3.9645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8418 2.6369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1018 2.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1238 3.6537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9499 5.1865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0281 6.3187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2623 4.2535 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 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 36 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 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 20 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 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 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 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 2 0 0 0 0 25 27 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 M END