MMs02717053 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 0.7502 -1.2989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0004 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7506 -3.8970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2506 -3.8968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0004 -2.5976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2502 -1.2987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0004 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2502 -1.2983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2498 1.2998 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0907 1.6104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6395 2.6700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7541 3.6739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0532 2.9241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7416 1.4568 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7454 0.3423 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.8600 1.3461 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6309 -0.6616 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7493 -0.7723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2165 -0.4602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2203 -1.5748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7570 -3.0015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2898 -3.3135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2860 -2.1990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7609 -4.1160 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0391 0.6002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6002 1.0391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0391 -0.6002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1996 -2.5983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1507 -4.9363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8507 -4.9359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2004 -2.5975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3998 1.0396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6004 2.0699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 3.6408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8622 4.4767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4593 4.6448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5411 4.0204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1945 2.5534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5871 0.6811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3941 -1.3251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9192 -4.4549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1122 -2.4486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 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 15 40 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 M END