MMs00068785 MOE2007 2D CORINA 3.40 0006 02.08.2006 37 39 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 0.7434 -1.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0132 -2.5980 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6132 -3.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5132 -2.5904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2566 -1.2876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2698 -3.8856 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7698 -3.8780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5132 -2.5751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0131 -2.5675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7698 -3.8627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0264 -5.1655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5264 -5.1732 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2697 -3.8551 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.7302 -3.9009 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2301 -3.9085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1056 -5.1265 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5345 -4.6703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8298 -5.4269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1326 -4.6835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1402 -3.1835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8450 -2.4269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5422 -3.1703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 -2.6995 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0423 0.5947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5947 1.0423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0423 -0.5947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6665 -0.5362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6587 -2.0789 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6751 -4.9279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9079 -1.5390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6078 -1.5252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6317 -6.2017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8236 -6.6268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1688 -5.2888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1825 -2.5888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8511 -1.2269 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 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 15 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 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 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 M END