MMs01750769 MOE2007 2D CORINA 3.40 0006 02.08.2006 37 40 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 -0.2006 -1.4865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9865 -2.4035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3742 -1.8339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5747 -0.3474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3877 0.5696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0505 -0.0788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7620 -1.3993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7260 -2.4840 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9409 -3.6646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7006 1.2730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1963 1.3859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9842 2.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4146 4.0500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4416 2.3075 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5545 0.8118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1669 0.2422 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.8310 0.0239 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1515 0.7355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1955 2.2348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5161 2.9463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7925 2.1585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7484 0.6591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4279 -0.0524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0249 -0.1287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9497 0.7336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3107 -1.9422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8261 -3.5927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5481 1.7588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9512 -1.5597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0241 2.2642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7957 -1.1755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1744 2.8651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5513 4.1458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8489 2.7277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3926 -1.2519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0813 0.4405 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 33 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 22 23 2 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 36 1 0 0 0 0 25 37 1 0 0 0 0 M END