MMs01574539 MOE2007 2D CORINA 3.40 0006 02.08.2006 48 50 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 -1.0137 -1.1056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4781 -0.7805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9287 0.6503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9149 1.7559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4506 1.4307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1935 1.4566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3221 2.6775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2139 3.8836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6365 3.4081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6239 1.9081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8160 0.0919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9453 -1.1296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3091 -0.0514 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9316 -1.4161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4247 -1.5594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0472 -2.9242 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2954 -0.3380 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.7885 -0.4813 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.4780 0.6778 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5503 -1.7735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0146 -1.4483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1579 0.0448 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -13.8268 1.3874 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.6574 0.0846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.7821 0.6425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1715 -0.2601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6533 -2.2502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2891 -1.6649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2754 2.9004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3604 2.3152 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4236 1.8821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4371 3.4879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1797 4.4923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7112 4.9757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8959 4.5797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8289 3.2726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8636 0.7323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8184 2.0235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7699 -1.7170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0261 -2.6124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7974 0.7538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4585 -2.2714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9314 -2.9113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1508 -2.6406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.2146 -1.4375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8050 1.3390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.3727 1.6871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 15 41 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 42 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 26 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 M END