MMs01913790 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 0.7491 -1.2995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2408 -1.4573 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1259 -4.8672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5517 -2.9247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2522 -3.6739 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1381 -2.6694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9216 -3.5358 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0774 -5.0276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4473 -5.6387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6614 -4.7578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5056 -3.2659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7198 -2.3850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0897 -2.9960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2455 -4.4879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0314 -5.3688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3038 -2.1152 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6737 -2.7262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8878 -1.8453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2577 -2.4563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4718 -1.5755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3160 -0.0836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9461 0.5274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7320 -0.3534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5301 0.7973 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.8633 -5.9085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4934 -5.2975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0396 0.5993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5993 1.0396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0396 -0.5993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5720 -6.8322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4097 -2.7771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5951 -1.1915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3414 -4.9767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1560 -6.5623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0020 -3.7206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5363 -3.5604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3824 -3.6498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5678 -2.0643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8215 1.7209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6361 0.1354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0191 -7.4004 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0478 -8.1051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 5 2 0 0 0 0 4 6 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 33 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 26 27 2 0 0 0 0 26 42 1 0 0 0 0 42 43 1 0 0 0 0 M END