MMs01119505 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 0.7608 -1.2928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0216 -2.5980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2607 -1.2803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.0249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 0.0374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2390 1.3426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7390 1.3551 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4997 0.0624 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.3483 -0.7862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7925 0.8231 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.3925 1.8624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0317 2.1159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4079 3.5680 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2446 0.4470 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2964 1.5164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8961 2.9620 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7484 1.1402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1487 -0.3054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6008 -0.6815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6526 0.3879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2523 1.8335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8002 2.2097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4000 3.6553 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 17.1046 0.0117 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.7606 -1.2429 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2606 -1.2553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4782 2.6354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9783 2.6229 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0342 0.6086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6086 1.0342 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0342 -0.6086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8689 0.4260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1984 1.2084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5648 -0.7095 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3073 -1.1609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9210 -1.8380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0938 2.6891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1364 -1.6751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4788 -2.4353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2174 3.9406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6088 4.9748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 26 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 15 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 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 1 0 0 0 0 26 27 1 0 0 0 0 27 39 1 0 0 0 0 27 40 1 0 0 0 0 28 29 2 0 0 0 0 28 41 1 0 0 0 0 41 42 1 0 0 0 0 M END