MMs00733676 MOE2007 2D CORINA 3.40 0006 02.08.2006 33 33 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 1.4079 0.5176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5601 -0.4428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9679 0.0748 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1201 -0.8857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8644 -2.3637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5280 -0.3681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7743 -1.2028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9533 -0.2755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4357 1.1324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9367 1.0752 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.2704 2.3787 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3965 -0.6842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7641 -2.1385 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4721 0.3613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9153 -0.0475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8315 -2.7017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4141 1.1263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1263 -0.4141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4141 -1.1263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8045 1.5549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3246 1.2919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6433 -1.2172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1634 -1.4801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1725 1.2572 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4677 2.2989 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7408 3.4555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5883 -1.2021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0699 -0.3745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2424 1.1071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6324 -2.7475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8773 -3.9008 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0306 -2.6559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 25 1 0 0 0 0 5 6 2 0 0 0 0 5 7 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 17 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 M END