MMs03160874 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 43 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 0.0056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2548 -1.2906 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5097 -2.5924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2646 -3.8887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5194 -5.1905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2743 -6.4867 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0194 -5.1961 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7354 -3.8999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2354 -3.9055 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0097 -2.5981 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5942 -1.5611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7257 -6.4980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7548 -1.2850 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7451 1.3243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2451 1.3299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2548 -1.2682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7548 -1.2738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 0.0393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2548 -1.2569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2451 1.3411 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7450 1.3467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0045 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0045 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2872 1.1866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6261 0.4203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4646 -3.8842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7672 -5.9018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3218 -7.5394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3158 -7.0941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8961 1.0538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1412 2.3613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8412 2.3714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8587 -2.3051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1587 -2.3152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7495 0.1468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9450 1.3512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7406 2.5467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 14 1 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 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 13 32 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END