MMs01715741 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 1.4660 -0.3177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0706 -1.6905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5630 -1.5396 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8807 -0.0737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5847 0.6815 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2535 0.5309 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4635 -0.3556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3007 -1.8467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8362 0.2491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0462 -0.6375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4189 -0.0328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7367 1.4331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2291 1.5840 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8337 0.2112 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.7150 -0.7880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8658 -2.2804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2996 -0.1065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3078 1.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7738 0.6865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2316 -0.7420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2234 -1.8527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7575 -1.5349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6975 -1.0597 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.7374 2.5518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2542 1.1728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1728 0.2542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2542 -1.1728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4664 -2.7273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3837 1.7239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9664 1.4420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9160 -1.8304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6719 -2.4011 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9865 -3.4743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0597 -2.1598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9415 2.1469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5803 1.5750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5897 -2.9954 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9510 -2.4235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6324 3.3512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9380 3.4468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8425 1.7525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 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 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 14 2 0 0 0 0 13 25 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 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 24 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 M END