MMs01291991 MOE2007 2D CORINA 3.40 0006 02.08.2006 54 56 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 1.2984 -0.7511 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2592 -1.3511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8965 -0.7534 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8952 -2.2534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5955 -3.0022 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5563 -3.6022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2971 -2.2511 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5942 -4.5022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 -0.0045 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9450 -1.3042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4473 1.2952 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4958 0.7444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4971 2.2444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7968 2.9933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0952 2.2422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0939 0.7422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7942 -0.0067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3949 2.9911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3962 4.4911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6933 2.2399 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9930 2.9888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9942 4.4888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2939 5.2377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5923 4.4866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5910 2.9866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2913 2.2377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6009 1.0387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0387 0.6009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6009 -1.0387 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8275 0.9177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3702 0.9164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0771 -2.0460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3046 -3.3813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3942 -4.5012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5932 -5.7022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7942 -4.5033 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4584 2.8453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7978 4.1933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1326 0.1413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7932 -1.2067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6922 1.0399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9930 1.7888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8123 4.2815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5848 5.6168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5234 6.1576 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0661 6.1563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0037 5.6139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7739 4.2772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7730 3.1939 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0005 1.8586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5192 1.3191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0619 1.3178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 M END