MMs01260528 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 48 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 0.5940 -1.3774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3018 -2.5805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7917 -2.4062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3857 -1.0289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4898 0.1742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8792 -1.1682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2082 -2.6317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9180 -3.3968 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8066 -4.5916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8698 -0.0418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3405 -0.3365 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.0300 0.8227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4434 0.6802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2692 2.1701 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.7512 -0.0545 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.4565 -1.5253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4732 -2.6282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9666 -1.6995 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.1142 0.5716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3380 -0.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1987 -1.7893 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.7011 0.3303 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.9248 -0.5371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7855 -2.0306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0093 -2.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.3724 -2.2719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.5117 -0.7784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.2879 0.0890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.8748 -0.1523 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -17.5961 -3.1393 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 0.7167 0.9625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7859 -1.5168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1734 -3.6824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9651 1.2761 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3101 -3.1069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8447 0.5822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3062 1.0760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3789 -2.7457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4316 1.5585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9676 1.4152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.8125 1.5251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.6951 -2.5315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8978 -4.0929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.3994 1.2838 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 32 1 0 0 0 0 2 3 2 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 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 35 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 36 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 45 1 0 0 0 0 M END