MMs01726255 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 60 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 1.0648 -1.0565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8359 -2.5389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1751 -3.2147 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2316 -2.1499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5454 -0.8161 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7141 -2.3787 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.6535 -1.2093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1359 -1.4382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0753 -0.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5578 -0.4976 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1008 -1.8959 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.7008 -2.9351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4990 -1.3529 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.3476 -0.5043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9560 0.0454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5608 1.4181 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8717 -1.9576 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.0818 -1.0712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9192 0.4200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4545 -1.6759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6171 -3.1671 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.4071 -4.0535 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5697 -5.5447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6646 -0.7895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6587 0.7105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0835 1.1796 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 18.9699 -0.0305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0930 -1.2474 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.4699 -0.0246 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1614 -3.0653 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.6789 -2.8364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5323 1.1295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4717 2.2989 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4979 -3.2252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5705 -4.7234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6907 -5.5354 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8452 0.8518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8518 0.8452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8452 -0.8518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6017 -0.6317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0397 -0.0732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0018 -3.1505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3768 -5.6748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6998 -6.7376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7626 -5.4146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6851 1.4120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.0739 -1.0615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.0658 1.0170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5019 -3.0700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7046 -4.0362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8532 -2.0790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6884 -3.3761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0499 1.3583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9044 -5.4096 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9625 -6.6082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6154 2.4769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 18 1 0 0 0 0 16 17 2 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 31 32 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 33 34 2 0 0 0 0 33 54 1 0 0 0 0 35 36 1 0 0 0 0 35 52 1 0 0 0 0 35 53 1 0 0 0 0 36 37 2 0 0 0 0 36 55 1 0 0 0 0 54 57 1 0 0 0 0 55 56 1 0 0 0 0 M END