MMs02048959 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 0.7528 -1.2974 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2528 -1.2941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.0065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 0.0098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2528 -1.2876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5056 -2.5883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0056 -2.5916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7528 -1.2844 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6371 -2.4960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0627 -2.0294 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.7521 -3.1885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0594 -0.5294 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6318 -0.0689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1652 1.3566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2781 -2.9084 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6471 -2.2953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8007 -0.8032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8626 -3.1744 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.2315 -2.5613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3851 -1.0692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7541 -0.4561 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7090 -4.6665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9244 -5.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7709 -7.0376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9863 -7.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3553 -7.3036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5089 -5.8115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2934 -4.9324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0379 0.6023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6023 1.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0379 -0.6023 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3977 1.0444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0977 1.0503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1079 -3.6262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4079 -3.6321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5992 -3.0982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1276 -3.5912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2531 -0.6522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3064 0.6450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1553 -4.1021 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5244 -3.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4284 -2.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1882 -1.1555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0923 0.0946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.8769 0.7376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5548 -4.3382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1853 -5.7462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6757 -7.5281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8635 -9.1104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3277 -8.0068 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.6041 -5.3210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4163 -3.7387 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 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 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 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 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 2 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 51 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 29 53 1 0 0 0 0 M END