D0E3SX Wcorina 11010620303D 1 1.00000 0.00000 0 CORINA evaluation license 3.40 0067 02.08.2006 42 44 0 0 0 999 V2000 -0.0167 1.3804 0.0096 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2935 2.0559 0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0993 1.5454 1.1989 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9889 0.0501 1.2997 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9768 -0.6388 0.7527 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0021 -0.0041 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0234 1.7343 -1.2779 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0958 3.5687 0.1164 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9014 -2.0881 0.9527 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8675 -0.6854 -0.6868 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6205 1.2400 -3.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7711 1.6463 -1.4477 S 0 0 0 0 0 0 0 0 0 0 0 0 1.4405 1.4692 -2.4442 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 1.1936 -3.4904 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9121 0.2977 -7.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2917 0.3122 -7.1523 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7792 0.6068 -5.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8572 0.8753 -4.8642 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4953 0.8398 -5.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0758 0.5573 -6.3787 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1941 0.0285 -8.2274 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9339 -0.2041 -9.1088 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8615 -0.4957 -10.2139 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8492 -0.5579 1.9001 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8483 1.8796 0.0242 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1461 1.8225 1.0746 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7142 1.9983 2.1125 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5782 3.7973 1.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0669 4.0636 0.1094 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5014 3.9228 -0.7259 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3239 -2.3013 1.8522 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4167 -2.5489 0.0919 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9076 -2.4925 1.0626 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8390 -1.6550 -0.6802 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4459 1.0563 -3.8239 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3679 1.4673 -2.5705 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5253 0.0756 -8.3466 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8409 0.6261 -5.6785 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2254 1.0464 -4.3847 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8880 -0.4354 -9.8521 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6689 -1.4986 -10.5949 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7146 0.2310 -11.0129 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 24 2 0 0 0 0 5 9 1 0 0 0 0 5 6 1 0 0 0 0 6 10 2 0 0 0 0 7 12 1 0 0 0 0 7 13 2 0 0 0 0 8 28 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 31 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 34 1 0 0 0 0 11 14 2 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 21 22 3 0 0 0 0 22 23 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 M END $$$$