MMs01418849 MOE2007 2D CORINA 3.40 0006 02.08.2006 45 47 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 -0.9324 -1.1750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4162 -0.9550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9676 0.4399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0352 1.6149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5514 1.3950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3810 2.5700 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.4647 0.3466 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.8385 -1.1061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5725 -1.9105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4792 -3.4076 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -6.2335 -1.6575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4535 -3.1412 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4085 -0.7251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.8035 -1.2765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9785 -0.3441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7585 1.1397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3735 -0.8955 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.5485 0.0369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9435 -0.5145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1185 0.4179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.5135 -0.1335 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -16.8873 -1.5861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.3844 -1.6795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.9358 -0.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.7795 0.6710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.8728 2.1681 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 -0.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4913 -2.2910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4763 2.7309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1753 -2.2989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7013 -2.0727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5495 -2.0825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6507 0.8331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1767 1.0594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.3153 -1.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.8413 -1.3107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2207 1.2141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.7467 1.4404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.7003 -1.7621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.9382 -2.7850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -18.1850 -2.8628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.5404 -2.0015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.9996 -0.8398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -19.5993 0.7154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 15 32 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 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 27 2 0 0 0 0 M END