MMs01477104 MOE2007 2D CORINA 3.40 0006 02.08.2006 40 42 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 -0.0107 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2407 -1.3150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4815 -2.6087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2222 -3.9130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7221 -3.9237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4814 -2.6301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7407 -1.3257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4629 -5.2281 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9535 -5.3955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2549 -6.8649 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9506 -7.6056 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8430 -6.5940 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9651 -4.2879 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.4301 -4.6103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4417 -3.5027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9883 -2.0729 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9066 -3.8250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.9183 -2.7175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4649 -1.2876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4765 -0.1801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9415 -0.5024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3948 -1.9323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3832 -3.0398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8366 -4.4697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2899 -5.8995 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0232 1.2497 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.0085 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.0085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0085 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2815 -2.6001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6148 -4.9480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6813 -2.6386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3480 -0.2908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9726 -5.7197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4432 -5.2534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2693 -4.9689 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2929 -1.0298 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7508 0.3836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5668 -2.1901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 13 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 37 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 38 1 0 0 0 0 21 22 1 0 0 0 0 21 27 1 0 0 0 0 22 23 2 0 0 0 0 22 39 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 25 26 3 0 0 0 0 M END