MMs00546412 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 45 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 -0.7584 1.2942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0168 2.5980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2583 1.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9999 -0.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4999 -0.0290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2583 1.2651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5167 2.5690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0167 2.5787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6645 0.7430 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5502 -0.7526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2730 -1.5393 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9373 -1.3235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9089 -0.1806 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -8.1222 1.0965 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.5067 1.6737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8621 1.0310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0963 1.8834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9752 3.3785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6199 4.0212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3856 3.1688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9263 3.5157 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1455 2.2349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6991 2.6325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0353 -0.6067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6067 -1.0353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0353 0.6067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4416 1.2942 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0263 2.0047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5765 3.6411 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0598 3.1913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3932 -1.0547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0932 -1.0721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1234 3.6043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4234 3.6218 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3671 -2.3794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9278 -2.0009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9590 -0.1651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1806 1.3693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.9626 4.0605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5230 5.2173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4646 4.6233 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 15 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 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 M END