MMs01365988 MOE2007 2D CORINA 3.40 0006 02.08.2006 58 61 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 0.8573 -1.2309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3519 -1.1039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2092 -2.3348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7038 -2.2078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3411 -0.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4838 0.3809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9892 0.2539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3224 -1.9845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9812 -3.4452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7046 -1.4019 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5776 0.0927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7121 1.0740 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1169 0.4338 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9884 -2.1777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3021 -1.4538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3321 0.0459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5859 -2.2296 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8997 -1.5057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9297 -0.0060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2434 0.7179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5272 -0.0578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4973 -1.5575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1835 -2.2815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1535 -3.7812 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.4373 -4.5570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4074 -6.0567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6912 -6.8324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0049 -6.1085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0349 -4.6088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7511 -3.8330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2888 -6.8843 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9847 0.6858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6858 0.9847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9847 -0.6858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2316 -1.7353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1649 -2.3908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7519 -2.1432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1203 -2.8392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5168 -3.4947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5962 -3.4030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8621 -2.5213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5727 0.8853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1762 1.5408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8309 0.5674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0968 1.4491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6508 1.5396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1988 -3.0814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7412 -3.1122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5620 -3.4293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9026 0.6147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2674 1.9177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5782 0.5213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5243 -2.1782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3564 -6.6358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6672 -8.0322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0859 -4.0297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7751 -2.6333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 45 1 0 0 0 0 8 46 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 15 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 48 1 0 0 0 0 15 49 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 22 23 2 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 54 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 56 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 57 1 0 0 0 0 31 58 1 0 0 0 0 M END