MMs02687947 MOE2007 2D CORINA 3.40 0006 02.08.2006 39 40 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 1.2983 -0.7512 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5995 1.4976 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8964 -0.7536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 -0.0048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4945 -0.7561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4931 -2.2561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7914 -3.0073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0912 -2.2585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0926 -0.7585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3895 -3.0097 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.6383 -4.3080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1407 -1.7113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6878 -3.7609 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9876 -3.0121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2859 -3.7633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5857 -3.0145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8840 -3.7657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8826 -5.2657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5829 -6.0145 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2845 -5.2633 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 1.0387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0387 0.6010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6010 -1.0387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1242 -1.6722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6669 -1.6736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4533 -2.8551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7903 -4.2073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1324 -0.1594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7953 1.1927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6867 -4.9609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2171 -2.0921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7598 -2.0936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5868 -1.8145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9238 -3.1667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9213 -5.8667 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2447 -5.8623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 23 39 1 0 0 0 0 M END