MMs01572787 MOE2007 2D CORINA 3.40 0006 02.08.2006 42 44 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 0.0029 -1.5000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0363 -0.9000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3034 -2.2475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3063 -3.7475 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0087 -4.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2917 -3.7525 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2917 -4.9525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2947 -2.2525 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5893 -4.5050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6068 -4.4949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6097 -5.9949 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9044 -3.7424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2049 -4.4899 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5025 -3.7374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6564 -2.2453 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1230 -1.9306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8755 -3.2281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8740 -4.3448 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3676 -3.3820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9804 -4.7512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4724 -4.9051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3518 -3.6898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7390 -2.3207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2469 -2.1668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6341 -0.7977 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 0.0023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0023 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7116 -1.1190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4856 -2.4536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7819 -5.4177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7608 -5.4207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1913 -3.4670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6274 -5.1071 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9873 -5.5431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1313 -2.8247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6740 -2.8217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2769 -5.7234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9626 -6.0004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5454 -3.8129 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4424 -1.3485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 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 30 1 0 0 0 0 4 31 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 32 1 0 0 0 0 6 33 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 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 M END