MMs00559767 MOE2007 2D CORINA 3.40 0006 02.08.2006 55 56 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 1.5000 0.0036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2469 1.3044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2531 -1.2937 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7531 -1.2902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.0142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7531 -1.2830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0061 -2.5839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5061 -2.5874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2531 -1.2795 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2566 -2.7795 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2495 0.2205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7530 -1.2759 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5061 -2.5732 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.1061 -1.5340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7592 -3.8740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5123 -5.1713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7654 -6.4721 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0061 -2.5696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7530 -1.2688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2530 -1.2653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0061 -2.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2592 -3.8634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7592 -3.8669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5061 -2.5590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2530 -1.2582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0061 -2.5554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2592 -3.8562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0028 1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.0028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0028 -1.2000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6555 -2.3344 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8975 1.0485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5975 1.0549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6086 -3.6217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9086 -3.6281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3506 -0.2353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8381 -3.1048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8418 -4.6475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1506 -0.2310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8506 -0.2246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8616 -4.9012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4604 -4.3872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2937 -1.8557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8506 -0.2175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2124 -0.6606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0089 -3.7554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.2061 -2.5526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0033 -1.3554 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2214 -4.4587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.8616 -4.8941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2970 -3.2538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0123 -5.1677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6147 -6.2055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 20 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 54 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 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 26 29 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 54 55 1 0 0 0 0 M END