MMs02011138 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 47 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 -0.9921 -1.1251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5138 -2.5468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9566 -2.8434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9486 -1.7184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4704 -0.2967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3252 -2.3142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1839 -3.8076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -4.1346 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2433 -5.2359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6164 -1.5508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6009 -0.0509 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9231 -2.2873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9387 -3.7873 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2144 -1.5239 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5211 -2.2604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8123 -1.4970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7968 0.0029 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4900 0.7394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1988 -0.0240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0880 0.7663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0724 2.2662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3636 3.0297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6704 2.2932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6859 0.7932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3947 0.0298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4102 -1.4701 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.3826 1.1374 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1684 -0.8877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3075 -3.4468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2641 0.6034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0839 -4.6012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7593 -3.1876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3019 -3.1716 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2344 -2.6203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9918 -1.2764 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2518 1.6666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7092 1.6506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0193 -0.2446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7767 1.0993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0270 2.8555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3512 4.2296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7033 2.9039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7313 0.2040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 M END