MMs03167139 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 55 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 1.2946 -0.7576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2858 -2.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8926 -0.7729 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9319 -1.3729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8838 -2.2729 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1784 -3.0305 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2049 1.4694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9103 2.2270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5083 2.2117 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5083 1.0117 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5171 3.7117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2225 4.4693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2314 5.9693 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9368 6.7270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8029 1.4541 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1063 2.1965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1152 3.6964 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4010 1.4388 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7044 2.1812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9990 1.4235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9902 -0.0764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2848 -0.8341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5882 -0.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5970 1.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3024 2.1659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6061 1.0357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0357 0.6061 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6061 -1.0357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2554 -1.3576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0858 -2.2505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2787 -3.4576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4858 -2.2647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8321 0.9085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3748 0.8994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2317 -0.6367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6977 3.4964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9342 4.8369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8055 3.3442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 4.6847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5429 7.7626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9011 7.3331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3307 5.6913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7959 0.2541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9385 3.1049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4811 3.0959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9474 -0.6703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2777 -2.0340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6239 -0.6978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6398 2.0021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3095 3.3659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5804 -3.0152 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5733 -4.2152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 54 1 0 0 0 0 9 10 1 0 0 0 0 9 38 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 14 1 0 0 0 0 12 18 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 54 55 1 0 0 0 0 M END