MMs01457847 MOE2007 2D CORINA 3.40 0006 02.08.2006 44 46 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 -0.0461 -1.4993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2293 -2.2889 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1684 -1.1192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7741 0.3280 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5710 -1.6510 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4987 -3.1492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6683 -4.0883 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0514 -3.5435 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8256 -0.8288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1649 -1.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2496 -3.0018 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4195 -0.6820 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7588 -1.3574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8436 -2.8551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1829 -3.5305 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4375 -2.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3528 -1.2107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0134 -0.5353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0667 -3.0443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3688 -2.2997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6647 -3.0551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6585 -4.5551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3563 -5.2997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0604 -4.5443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1994 -0.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0369 1.1994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1994 0.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6335 -1.3770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 -2.6138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6261 -4.6655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0035 0.0454 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5438 0.1326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3517 0.5161 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8399 -3.5128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2507 -4.7286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5089 -3.2486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3564 -0.5529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9456 0.6628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3713 -1.6997 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7064 -2.4594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6952 -5.1594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3513 -6.4996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9813 -5.1399 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 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 3 20 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 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 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 M END