MMs01947878 MOE2007 2D CORINA 3.40 0006 02.08.2006 49 52 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 1.3037 0.7419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0162 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5980 1.1838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5887 -1.5162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9017 0.7257 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1961 -0.0324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1867 -1.5324 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4997 0.7094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7941 -0.0487 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9416 -1.5414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9309 -2.6498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3855 -4.0793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8508 -4.4003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8614 -3.2919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4068 -1.8624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1649 -0.5681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1682 0.5529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6406 1.9765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6439 3.0975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1097 2.2792 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.1065 1.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6340 -0.2654 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.4806 1.7598 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.3331 3.2526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8678 3.5736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3054 -5.8297 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2947 -6.9382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5935 1.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0430 -0.5935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5935 -1.0430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5381 1.6659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0808 1.6563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3887 -1.5087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5812 -2.7162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7886 -1.5237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9092 1.9256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7342 1.6335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2768 1.6239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7587 -2.3930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5770 -4.9660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0336 -3.5487 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5331 3.2451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4660 4.4452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7746 4.0685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2458 4.7125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4080 -6.1297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4862 -7.8249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1815 -7.7467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 34 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 M END