MMs01128654 MOE2007 2D CORINA 3.40 0006 02.08.2006 57 59 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 1.3007 0.7472 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2614 1.3472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5981 -0.0056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8987 0.7416 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9020 2.2416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6046 2.9944 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5653 3.5944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3039 2.2472 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6078 4.4944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1929 -1.5112 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4968 0.7359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6568 2.2274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1247 2.5361 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.8719 1.2354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8658 0.1229 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3633 1.0754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2476 2.2870 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6405 3.6586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1491 3.8187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5248 4.8702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7391 2.1270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6234 3.3386 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3462 0.7553 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.8377 0.5953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7220 1.8069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2134 1.6469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8205 0.2753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9362 -0.9363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4448 -0.7763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5977 1.0405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0405 -0.5977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5977 -1.0405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8247 -0.9232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3674 -0.9265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0833 2.0306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3148 3.3683 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8078 4.4918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6104 5.6944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4078 4.4970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7668 3.0323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0301 -0.0774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4408 0.5470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3299 4.8177 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2771 5.0118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9559 3.9467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0210 2.6255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4941 4.1628 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2323 5.8395 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5555 5.5777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6388 -0.2140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2363 2.9042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9208 2.6162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0137 0.1473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4219 -2.0337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7374 -1.7456 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 35 1 0 0 0 0 4 36 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 37 1 0 0 0 0 6 38 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 39 1 0 0 0 0 10 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 18 44 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 21 48 1 0 0 0 0 22 49 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 54 1 0 0 0 0 29 30 2 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 31 57 1 0 0 0 0 M END