MMs01040939 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 1.2381 -0.8468 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2809 -2.3461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7201 -2.7689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5668 -1.5307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6509 -0.3428 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0662 -1.4880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8529 -2.7651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7789 -0.1681 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2783 -0.1254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0650 -1.4025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5644 -1.3598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2771 -0.0399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4904 1.2372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9910 1.1945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2031 2.5571 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 11.7765 0.0028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5632 -1.2744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0736 -4.2266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9879 -5.2616 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5487 -4.8389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1952 -3.3812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2440 -2.9585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3297 -3.9935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9762 -5.4513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 -5.8740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6774 0.9905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9905 0.6774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6774 -0.9905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1496 0.8536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4948 -2.4584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1938 -2.3815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3617 2.2162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5415 -1.9037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1925 -2.2961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5849 -0.6450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1730 -3.7456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7382 -5.2257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5268 -1.7923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4811 -3.6554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8447 -6.2793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2541 -7.0402 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 6 1 0 0 0 0 3 4 2 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 33 1 0 0 0 0 17 18 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 24 25 2 0 0 0 0 24 40 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 26 42 1 0 0 0 0 M END