MMs00401849 MOE2007 2D CORINA 3.40 0006 02.08.2006 53 55 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 1.3051 0.7393 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5980 -0.0213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9031 0.7181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.0425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1837 -1.5425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8786 -2.2818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5857 -1.5212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4765 -2.3031 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7817 -1.5638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7940 -0.0638 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0745 -2.3244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3797 -1.5850 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3920 -0.0851 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6725 -2.3457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9777 -1.6063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9899 -0.1064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2705 -2.3669 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.5757 -1.6276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8685 -2.3882 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 15.8293 -2.9882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1736 -1.6489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1859 -0.1489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4911 0.5904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7839 -0.1702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7716 -1.6701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4665 -2.4095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4542 -3.9094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1491 -4.6488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8562 -3.8882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5915 1.0441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0441 -0.5915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5915 -1.0441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9130 1.9180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2401 0.5489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8687 -3.4818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5416 -2.1127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4667 -3.5031 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2957 -3.2373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8383 -3.2499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8937 -3.2586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4363 -3.2712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2607 -3.5669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8119 -0.7021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3545 -0.7147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1516 0.4596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.5009 1.7904 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.8280 0.4213 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.8059 -2.2786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6376 -3.7107 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.8554 -5.0404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.9129 -5.5743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3702 -5.5617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 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 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 30 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 48 1 0 0 0 0 26 27 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 M END