MMs02557827 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 58 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 1.4991 0.0507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2926 -1.2222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7918 -1.1715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4974 0.1522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7039 1.4251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2048 1.3744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4096 2.7488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9966 0.2029 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8367 1.4455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3252 2.8556 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2781 1.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5511 1.8240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8747 1.1184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9255 -0.3808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6525 -1.1743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3289 -0.4686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9188 -0.9801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5038 -2.4216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2491 -1.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2998 -2.5855 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5221 -0.2929 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8457 -0.9986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1186 -0.2051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0679 1.2941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.4423 -0.9107 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.7152 -0.1172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6645 1.3819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9374 2.1754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2611 1.4698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3118 -0.0293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0389 -0.8228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0896 -2.3220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5340 2.2633 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0406 1.1993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1993 -0.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0406 -1.1993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7281 -2.2811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4266 -2.1898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 2.3927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4685 2.1842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9741 3.8077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3506 3.3133 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5105 3.0233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8931 1.7532 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6931 -2.3736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1059 -1.9434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6477 -1.8912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4829 -2.1100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6056 1.9465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8969 3.3748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 22.3708 -0.5939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8903 -2.3626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.1302 -3.5213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.2889 -2.2814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 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 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 40 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 18 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 44 1 0 0 0 0 14 15 1 0 0 0 0 14 45 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 31 2 0 0 0 0 30 34 1 0 0 0 0 31 32 1 0 0 0 0 31 52 1 0 0 0 0 32 33 1 0 0 0 0 33 53 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 M END