MMs00550087 MOE2007 2D CORINA 3.40 0006 02.08.2006 59 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 1.4999 0.0129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5128 -1.4871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4871 1.5128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.0258 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7387 1.3312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9776 2.6238 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2386 1.3441 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9774 2.6496 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5774 1.6103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2163 3.9421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9551 5.2475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1940 6.5401 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.9328 7.8455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4774 2.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2162 3.9679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2385 1.3699 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7385 1.3828 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 9.1385 0.3436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4773 2.6882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9772 2.7011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7384 1.4086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2383 1.4215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9771 2.7269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2160 4.0195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7160 4.0066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4771 2.7398 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4996 0.0903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7608 -1.2152 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9996 0.1031 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.7607 -1.1894 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0052 0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0103 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0052 -0.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9129 -1.4922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5232 -2.6870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7128 -1.4767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6870 1.5232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4767 2.7128 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8871 1.5077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8476 0.3101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3037 3.1629 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2905 4.7055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8810 4.4841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8677 6.0268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9771 7.2545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5238 8.8899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8884 8.4366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6475 0.3256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3462 3.0889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6755 3.8718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4428 0.8864 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8472 0.3874 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8070 5.0638 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1071 5.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0681 3.7842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2951 0.6253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1696 -2.2337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9607 -1.1791 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 5 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 14 48 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 49 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 28 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 24 25 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 26 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 57 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 M END