MMs00452081 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 1.5000 0.0060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2448 1.3080 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0448 1.3080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4897 2.6040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7448 1.3139 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 3.1448 0.2747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4896 2.6159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7345 3.9120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0179 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7448 1.3258 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7551 -1.2722 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.5551 -1.2722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0103 -2.5742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2551 -1.2663 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0102 -2.5623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2654 -3.8643 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5102 -2.5563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2654 -3.8524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7654 -3.8464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5102 -2.5444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7551 -1.2484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2551 -1.2543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 0.0417 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9999 0.0358 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0048 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0048 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2963 -1.1766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6292 -0.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5265 3.2081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8855 3.6409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4528 1.9999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9041 -1.0237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9687 -1.9784 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4144 -3.6158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0519 -3.1701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6695 -4.8940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3695 -4.8833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7102 -2.5397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3509 -0.2068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9896 2.6219 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5855 3.6635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 10 1 0 0 0 0 8 9 2 0 0 0 0 8 43 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 15 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 26 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 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 25 26 2 0 0 0 0 43 44 1 0 0 0 0 M END