MMs03902067 MOE2007 2D CORINA 3.40 0006 02.08.2006 52 53 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 0.7429 -1.3031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0141 -2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7288 -3.9011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2288 -3.9093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9858 -2.6143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2429 -1.3112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4513 -2.9342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 -4.4268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2264 -5.0294 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9066 -6.4949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8950 -5.1838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8868 -6.6838 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1981 -4.4409 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4930 -5.1980 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.5322 -5.7980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4849 -6.6979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7961 -4.4550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0910 -5.2121 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8043 -2.9550 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1073 -2.2121 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.0681 -1.6121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4023 -2.9692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7054 -2.2262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0003 -2.9833 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 16.3034 -2.2404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1155 -0.7121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4186 0.0308 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0425 0.5943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5943 1.0425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0425 -0.5943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2141 -2.5915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1232 -4.9371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8485 -0.2753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3475 -2.1361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7342 -6.2391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6507 -7.6673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0790 -6.7508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2046 -3.2409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2849 -6.6914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4783 -7.8979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6848 -6.7045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7683 -2.3494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6260 -3.8842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1686 -3.8926 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9390 -1.3028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4817 -1.3112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8978 -3.2828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3459 -1.6460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7091 -1.1979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8206 0.0449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8271 1.2449 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 27 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 51 52 1 0 0 0 0 M END