MMs01575176 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 41 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 1.5000 0.0018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2484 1.3018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7484 1.3036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7516 -1.2945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2516 -1.2963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7516 -1.2908 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.2516 -1.2890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 0.0110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0032 -2.5871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5032 -2.5853 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.2547 -3.8834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7467 -4.0384 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4728 -5.5054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0604 -5.5052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7622 -6.2568 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6463 -5.2545 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.4314 -6.1137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7451 -7.5805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2371 -7.7355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8455 -6.3644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7296 -5.3621 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0015 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0015 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6471 2.3403 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3471 2.3436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3528 -2.3330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6528 -2.3363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7902 1.1888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1271 0.4191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1528 -2.3308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8760 -2.9989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2130 -3.7686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9432 -8.4732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8383 -8.7740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0190 -6.1135 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 12 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 1 0 0 0 0 14 15 2 0 0 0 0 14 19 1 0 0 0 0 15 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 M END