MMs01543486 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 1.0207 -1.0991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5792 -2.5327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 -3.6318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0622 -3.2974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5037 -1.8639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4830 -0.7647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9245 0.6688 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0242 1.8686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8871 3.0956 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3207 2.6541 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3438 1.1543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5707 0.2914 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.9315 0.9225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1584 0.0596 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0246 -1.4344 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5192 0.6907 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7462 -0.1722 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1069 0.4589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2407 1.9529 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3339 -0.4040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3570 -1.9038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7905 -2.3453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6534 -1.1184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7532 0.0815 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8793 0.8166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8166 0.8793 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8793 -0.8166 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5906 -2.8002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2467 -4.7787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8788 -4.1767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6735 -1.5963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8244 1.8502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2452 1.9069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7818 1.7693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6263 1.8859 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6391 -1.3674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3971 -2.6240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1789 -3.4807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8533 -1.0999 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 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 33 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 17 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 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 M END