MMs02701305 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 43 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 0.7000 -1.3266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0989 -2.5962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6011 -3.9228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1000 -3.9799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8989 -2.7104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1989 -1.3837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2443 -0.3080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5904 -0.9699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3770 -2.4546 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2375 -3.2909 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8366 -0.1350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7367 1.3617 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3906 2.0235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1444 1.1886 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1827 -0.7968 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2826 -2.2935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4289 0.0380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7750 -0.6238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1017 0.0762 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1774 -0.9692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5156 -2.3153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0308 -2.1018 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0613 0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5600 1.0613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0613 -0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 -2.5505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 -4.9385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6600 -5.0413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3107 3.2208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0853 -2.3734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3625 -3.4908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4800 -2.2136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5981 0.9039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1374 1.0066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7750 0.5762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9192 -0.0259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1930 -1.6083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6419 -2.7293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2216 -3.4787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 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 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 15 2 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 M END