MMs03871398 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 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 1.0805 1.0404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7198 2.4964 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6702 3.0603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9434 2.2673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5633 4.5565 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2527 5.7156 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8926 4.9173 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6857 3.6440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1818 3.5372 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0225 4.7795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5216 4.8297 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9372 6.2710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6949 7.1116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5115 6.1898 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7110 5.5224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1213 5.0114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3839 3.5346 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2689 5.9773 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6792 5.4663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9215 6.3069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1049 5.3852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5939 3.9749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0948 4.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8323 0.8644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8644 -0.8323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8323 -0.8644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7501 0.0446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1775 1.5269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0654 6.6797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6547 8.3109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7906 6.2924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3095 6.5625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0588 7.1588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6792 6.6663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1488 7.2251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7539 7.1714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7393 6.4038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1842 4.8607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7587 3.6863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4287 2.7863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9133 3.8149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1802 2.8281 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 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 16 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 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 23 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 M END