MMs02295531 MOE2007 2D CORINA 3.40 0006 02.08.2006 21 22 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 1.5000 0.0118 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2602 -1.2813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7601 -1.2695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5203 -2.5626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7806 -3.8675 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2806 -3.8793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5204 -2.5862 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9850 -2.2392 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1301 -0.7462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7550 -0.1469 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1076 -3.2341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5305 -2.7593 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0094 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0094 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6888 -4.9232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1646 -0.1380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1679 -3.9803 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6793 -4.2891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4286 -3.5552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 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 11 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 19 1 0 0 0 0 12 20 1 0 0 0 0 13 21 1 0 0 0 0 M END