MMs01135441 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 1.2926 -0.7611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8906 -0.7832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0443 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.1960 -1.2443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4886 -0.8054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 1.4335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1121 2.1724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4047 1.4113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3919 -0.0886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6845 -0.8497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6717 -2.3496 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9899 -0.1108 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.0240 -0.7196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0027 1.3891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7101 2.1502 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.3081 2.1280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6007 1.3670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5879 -0.1330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8805 -0.8940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1859 -0.1551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1987 1.3448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9061 2.1059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9189 3.6058 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.0865 -0.8275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2088 1.4556 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1747 2.0645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6088 1.0341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0341 0.6088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6088 -1.0341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5134 -1.6737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0561 -1.6869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8345 0.9036 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3771 0.8905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1114 -1.6959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6541 -1.7090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7094 -1.7180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2520 -1.7312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4059 2.5646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6232 1.2352 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3487 3.0982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8913 3.0850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5446 3.0538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0872 3.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5436 -0.7241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8702 -2.0940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2199 -0.7640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2430 1.9359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8500 -1.7533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3074 -1.7402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7939 -0.0665 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.7939 -1.2665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 27 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 7 52 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 8 52 1 0 0 0 0 9 10 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 2 0 0 0 0 10 17 1 0 0 0 0 11 12 1 0 0 0 0 11 26 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 18 45 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 46 1 0 0 0 0 21 22 1 0 0 0 0 21 47 1 0 0 0 0 22 23 2 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 27 28 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END