MMs01832379 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 1.3007 -0.7471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 0.0059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8988 -0.7412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 0.0117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1927 1.5117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8920 2.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5947 1.5059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4901 2.2647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7908 1.5176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9510 0.0262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8385 -0.9800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4189 -0.2824 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9095 -1.3775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1660 1.0184 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1598 2.1308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4683 3.5987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6574 1.1785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2644 2.5502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7558 2.7104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6402 1.4989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0332 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5418 -0.0330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9177 -1.0844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4091 -0.9242 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1317 1.6590 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5976 1.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0406 0.5976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5976 -1.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5315 -1.6681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0742 -1.6646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9015 -1.9412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2367 -0.5859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8893 3.4588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5541 2.1035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4874 3.4647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6964 -0.6118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0907 -2.1532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5569 3.5195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2414 3.8078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0562 -1.1303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3106 -2.4560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0182 -3.4253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 2 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 42 43 1 0 0 0 0 M END