MMs00445197 MOE2007 2D CORINA 3.40 0006 02.08.2006 43 44 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 1.0570 -1.0643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0074 -2.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1213 -0.0074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1139 -2.1287 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5642 -1.7455 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.1810 -0.2953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9474 -3.1957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0144 -1.3623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1768 -2.3103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4377 -1.4977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0545 -0.0475 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.5568 0.0362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8362 -2.0401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0657 -3.5225 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0052 -1.1002 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4036 -1.6426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6331 -3.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0316 -3.6674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2006 -2.7275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9711 -1.2451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5726 -0.7027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3431 0.7796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5121 1.7196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4257 0.4228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8456 0.8515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4257 -0.4228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4302 -1.6956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8588 -2.9669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8382 -2.9728 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9669 -0.8588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9728 0.8382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6985 0.4184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7993 -3.2867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1099 -3.5084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9067 1.0449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8215 0.0856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6980 -3.8769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2152 -4.8533 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3194 -3.1614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9063 -0.4932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9446 1.3220 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7610 2.5079 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 5 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 31 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 34 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 13 2 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 42 43 1 0 0 0 0 M END