MMs00257997 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 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 -1.5000 -0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2498 -1.2995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4995 -2.5984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0005 -2.5981 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 2.2502 -1.2986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1322 -2.5120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5587 -2.0482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5584 -0.5482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1317 -0.0849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7717 0.3337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1422 -0.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4411 0.4741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5976 1.9660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5560 -0.5293 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9461 -1.8998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4543 -1.7433 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.6964 -3.1987 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9466 -4.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6969 -5.7967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1969 -5.7965 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9466 -4.4973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1964 -3.1984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7498 -1.2998 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.4995 -2.5989 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0009 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.5998 1.0393 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1002 1.0388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0993 -3.6377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6007 -3.6372 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7616 -3.6533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5296 -2.7533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6461 1.5271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0272 -3.7267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0275 -5.2694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5693 -6.2074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9055 -6.9785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8660 -5.2685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8657 -3.7258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9878 -2.0167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3239 -2.7877 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 2 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END