MMs01344079 MOE2007 2D CORINA 3.40 0006 02.08.2006 50 51 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 1.2971 -0.7534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2932 -2.2534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5903 -3.0067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8913 -2.2601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8952 -0.7601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1883 -3.0135 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4893 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4932 -0.7669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7864 -3.0202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0874 -2.2736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3845 -3.0270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3806 -4.5270 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6855 -2.2803 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.6462 -1.6803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9826 -3.0337 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.0218 -3.6337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2835 -2.2871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9787 -4.5337 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6894 -0.7803 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9903 -0.0337 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.7370 -1.3347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2437 1.2673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2913 0.7129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2952 2.2129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5962 2.9595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8933 2.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8894 0.7062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5884 -0.0405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1943 2.9528 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6027 1.0377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0377 0.6027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6027 -1.0377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2524 -2.8507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5872 -4.2067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9359 -0.1628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6012 1.1933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1852 -4.2135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0127 -3.9375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5554 -3.9415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8808 -3.3279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3243 -1.6898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9849 -1.7667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0163 -5.1364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6517 -0.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2575 2.8156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5993 4.1595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9271 0.1035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5853 -1.2404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 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 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 19 42 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 31 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 M END