MMs01272319 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 1.5000 0.0050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2456 1.3066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4913 2.6031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0087 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7544 1.2965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 4.0231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7335 4.9088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 4.0312 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0900 4.4059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9051 4.4818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2219 5.9480 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5325 7.1071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1106 6.9554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4274 8.4216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6501 6.4067 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7614 5.3993 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7540 4.2880 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7688 6.5106 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8728 4.3919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5560 2.9257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6673 1.9183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0954 2.3770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4122 3.8432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3009 4.8506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8404 4.3019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2685 4.7607 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -10.2991 2.8738 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -9.3816 5.7301 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -9.2068 1.3696 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.5965 -1.0412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1035 -1.0322 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4456 1.3106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9543 1.2925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7295 6.1088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0682 3.2929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1043 4.4359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9035 7.5797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4135 2.5587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4139 0.7453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5543 6.0235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3175 6.4967 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2066 7.3026 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 34 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 35 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 14 42 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 30 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 41 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 42 43 1 0 0 0 0 M END