MMs01308762 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 51 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 1.3038 -0.7418 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2645 -1.3418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 0.0165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9018 -0.7253 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9113 -2.2253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6170 -2.9835 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5778 -3.5835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3133 -2.2417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6265 -4.4834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 0.0329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1865 1.5329 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4998 -0.7088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5093 -2.2088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8131 -2.9505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1073 -2.1923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0978 -0.6924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 0.0494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4111 -2.9341 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.1529 -1.6303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6694 -4.2378 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7149 -3.6758 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7244 -5.1758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0281 -5.9175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3224 -5.1593 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3129 -3.6594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0091 -2.9176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5934 1.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 0.5934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5934 -1.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8209 0.9308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3635 0.9406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0917 -2.0094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3289 -3.3503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4266 -4.4910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6342 -5.6834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8265 -4.4758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4739 -2.8154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8207 -4.1505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1332 -0.0858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7865 1.2494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5413 -4.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3211 -6.3060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2626 -6.8417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8053 -6.8319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4960 -3.8602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7162 -2.5291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2320 -2.0033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7746 -1.9935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 M END