MMs01645684 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 57 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 1.2976 -0.7526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6010 1.4949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3035 2.2474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3064 3.7474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6070 4.4949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9045 3.7423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9015 2.2423 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9408 2.8423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1991 1.4897 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4996 2.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7972 1.4846 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.7972 2.6846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0977 2.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6958 2.2269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9933 1.4743 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.9933 2.6743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9904 -0.0257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2879 -0.7782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5884 -0.0308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8860 -0.7833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1865 -0.0359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1895 1.4641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8919 2.2166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5914 1.4692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2938 2.2218 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0404 -0.5979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2952 -1.9526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6361 -0.6072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0351 2.1020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1243 3.5414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8982 4.8759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8374 5.4156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3801 5.4126 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3172 4.8691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0859 3.5316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7301 3.1579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2728 3.1549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3282 3.1528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8709 3.1498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4689 3.1446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9262 3.1477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8090 0.1851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5777 -1.1525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8836 -1.9833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2245 -0.6380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2299 2.0620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8943 3.4166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8323 -0.6174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3952 1.4795 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3929 0.2795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 29 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 17 53 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 28 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 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 25 26 2 0 0 0 0 25 50 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 29 52 1 0 0 0 0 53 54 1 0 0 0 0 M END