MMs01373499 MOE2007 2D CORINA 3.40 0006 02.08.2006 56 59 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 0.7453 -1.3017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0094 -2.5981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2453 -1.3072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.0109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.0163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2453 -1.3180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4906 -2.6144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9906 -2.6089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7453 -1.3235 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7398 -2.8235 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7507 0.1765 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2452 -1.3289 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 -0.0326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 -0.0380 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.8999 1.0012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2452 -1.3398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4905 -2.6361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2358 -3.9378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7358 -3.9433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4905 -2.6470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7452 -1.3452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4811 -5.2450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9811 -5.2504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2546 1.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7470 1.4097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0642 2.8758 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1622 3.3599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7678 3.6305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6495 2.6308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2246 3.0995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9180 4.5678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0364 5.5675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4613 5.0988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0414 0.5962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5962 1.0414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0414 -0.5962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4037 1.0305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1037 1.0208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0868 -3.6558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3868 -3.6460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8415 -2.3703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8738 0.3819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2126 1.1484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2905 -2.6317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6321 -4.9749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6905 -2.6513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3490 -0.3082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9767 -6.4504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1811 -5.2548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9854 -4.0505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5467 0.5150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3299 2.2998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7781 4.9428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7911 6.7422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3560 5.8985 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 25 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 2 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 33 2 0 0 0 0 32 54 1 0 0 0 0 33 34 1 0 0 0 0 33 55 1 0 0 0 0 34 56 1 0 0 0 0 M END