MMs01253933 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 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 1.2297 0.8590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5884 0.2236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1006 2.3535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2582 2.9889 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2990 4.0690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0369 5.5459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6479 3.4129 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4408 1.9273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5209 0.8865 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9639 1.6652 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9716 4.1186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2445 3.3251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1938 1.8259 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5682 4.0307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8411 3.2373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1648 3.9429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4377 3.1494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3870 1.6503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0633 0.9446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7904 1.7381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6599 0.8568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9329 0.0633 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9407 3.8903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6872 0.9837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9837 -0.6872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6872 -0.9837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2297 -0.3410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0801 -0.8634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6755 -0.2847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0968 1.3106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2959 2.2476 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4124 3.5122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 0.5861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2318 5.0634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7736 5.0112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6087 5.2301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2053 5.1422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4966 3.7139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0228 -0.2547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7315 1.1736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6619 2.9311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8999 4.6114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2196 4.8494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 5 24 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 12 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 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 37 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 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 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 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 3 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M END