MMs01910903 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 43 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 -0.7485 -1.2999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0030 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 -2.5963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2515 -1.2964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5000 0.0018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7191 -1.6066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8326 -0.6016 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2598 -1.0634 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3733 -0.0584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0597 1.4084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8004 -0.5203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0129 0.3628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2275 -0.5174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7656 -1.9446 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2656 -1.9463 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5614 -2.9180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6535 -0.0523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9637 1.4153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3897 1.8805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5056 0.8781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1955 -0.5895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7694 -1.0546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3114 -1.5918 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 16.0012 -3.0594 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.7374 -1.1267 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.8776 -3.0982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1776 -3.8466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 -3.7099 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6012 1.0385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9485 -1.3013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5957 -3.6380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0988 1.0417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5106 -2.2369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0115 1.5628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0710 2.2172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6378 3.0546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6464 1.2503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5213 -2.2287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2599 -4.8839 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 14 15 2 0 0 0 0 14 18 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 40 1 0 0 0 0 M CHG 1 24 1 M CHG 1 26 -1 M END