MMs02087497 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 0.7529 -1.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0058 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7587 -3.8954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2587 -3.8921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0058 -2.5913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2529 -1.2940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0067 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2529 -1.2872 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2471 1.3108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7471 1.3142 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1471 2.3534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4941 2.6149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9941 2.6183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 0.0202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7529 -1.2771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2529 -1.2738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0000 0.0269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5000 0.0303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2470 1.3310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0117 -5.1894 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.5117 -5.1860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2646 -6.4901 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0379 0.6023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6023 1.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0379 -0.6023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1942 -2.6008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1611 -4.9360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2058 -2.5886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3977 1.0446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1185 1.7187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4528 2.4931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1267 0.4332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7889 1.2015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6262 -1.6901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9639 -2.4584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0472 -2.4560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3814 -1.6817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8714 0.4348 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2057 1.2092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2942 -1.1519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6285 -0.3776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1185 1.7389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4528 2.5133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3494 0.2965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7412 3.9123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5000 0.0168 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9023 -1.0237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7470 1.3344 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.3447 2.3750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3389 4.9528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 31 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 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 48 1 0 0 0 0 14 15 2 0 0 0 0 14 47 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 50 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 46 50 1 0 0 0 0 47 52 1 0 0 0 0 48 49 1 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END