MMs01578337 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 -0.7551 1.2961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2551 1.2902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 -0.0118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2449 -1.3079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7449 -1.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5000 -0.0177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3769 -1.2347 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8053 -0.7768 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8112 0.7231 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.5006 1.8823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3864 1.1923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0282 1.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3961 0.9845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6131 1.8614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4621 3.3538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0942 3.9693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8773 3.0924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5093 3.7079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0153 -1.6633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3880 -1.0586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8526 -3.1545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0627 -4.0409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9000 -5.5321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5273 -6.1368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1592 2.3377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8592 2.3270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8408 -2.3495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1408 -2.3388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3496 1.7964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8788 2.2866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5168 -0.2094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7074 1.3690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4357 4.0553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9735 5.1632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3886 4.9018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7004 -2.8191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3223 -4.2309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5930 -2.9644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2149 -4.3762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1100 -6.4185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9799 -7.6114 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 42 43 1 0 0 0 0 M END