MMs02087666 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 40 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 1.2968 -0.7538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8949 -0.7615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8905 -2.2615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5892 -3.0076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2924 -2.2538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5848 -4.5076 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.8816 -5.2615 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2836 -5.2538 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5.1873 -3.0153 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4885 -2.2691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4930 -0.7691 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7854 -3.0229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0866 -2.2768 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.0866 -3.4768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3834 -3.0306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6847 -2.2844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -0.0306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3967 1.4694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6031 1.0375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0375 0.6031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6031 -1.0375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6016 1.1923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9359 -0.1645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2514 -2.8508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1838 -4.2153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0113 -3.9399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5540 -3.9445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5746 0.1743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7994 -1.1595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2143 1.2645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9896 2.5982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7354 1.6125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3790 -4.5306 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0910 -0.7768 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0536 -0.1737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6979 2.2155 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7015 3.4155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4165 -5.1337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 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 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 11 12 1 0 0 0 0 11 27 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 28 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 36 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 19 20 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 19 36 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 20 38 1 0 0 0 0 34 38 1 0 0 0 0 35 40 1 0 0 0 0 36 37 1 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 8 1 M CHG 1 10 -1 M END