MMs01378936 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 1.5000 0.0066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2557 -1.2891 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5115 -2.5914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0115 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7557 -1.2825 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7491 0.2175 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7623 -2.7824 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2557 -1.2758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9999 0.0265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4999 0.0331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2557 -1.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5114 -2.5649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0114 -2.5715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7556 -1.2560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4999 0.0464 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5114 -2.5517 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0114 -2.5450 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.4114 -3.5843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7556 -1.2427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2556 -1.2361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0113 -2.5318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2671 -3.8341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7671 -3.8408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0228 -5.1431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7786 -6.4388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2786 -6.4322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0228 -5.1298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0053 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0027 -0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2864 1.1875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6258 0.4220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6409 -2.9969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3083 -3.7741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0088 -1.9981 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1885 -2.6034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0168 -3.7980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3954 1.0631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0953 1.0750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1160 -3.6015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4160 -3.6134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9160 -3.5935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6262 -0.8373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9588 -0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0420 -0.0552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3814 -0.8207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9272 -1.7564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9340 -3.2991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8228 -5.1484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1832 -7.4807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8831 -7.4687 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2228 -5.1245 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 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 2 0 0 0 0 12 15 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 24 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 M END