MMs01770583 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 45 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 1.4999 -0.0129 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2388 -1.3183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7387 -1.3312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4775 -2.6366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7164 -3.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2164 -3.9163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4776 -2.6109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0223 -2.5980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7834 -3.8905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4552 -5.2346 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6941 -6.5272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8826 -3.1617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2475 -2.5395 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3910 -1.0464 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7960 -0.5209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7303 0.9777 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2848 1.3783 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4571 0.1274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9927 -0.1975 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.0469 -1.3486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9555 -2.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2065 -3.6736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5488 -3.0041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6402 -1.5069 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3892 -0.6792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0103 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0103 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3476 -0.2972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6075 -4.9503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8175 -3.2816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3923 -4.9246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2506 -4.4994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6600 -5.9183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0852 -7.5612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7281 -7.1361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9246 -4.3610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1819 0.6871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8817 -3.3814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1334 -4.8714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5495 -3.6663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4623 0.5186 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 26 43 1 0 0 0 0 M END