L0Y4DU -OEChem-05032300003D 59 61 0 1 0 0 0 0 0999 V2000 -1.9071 -3.0242 -1.4790 Br 0 0 0 0 0 0 0 0 0 0 0 0 -2.2170 1.8972 1.0714 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3715 1.2153 -1.6788 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5792 0.2619 0.0307 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9838 0.8433 -0.8508 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3143 1.1106 0.3857 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7866 0.2752 -0.0232 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8627 -1.0215 0.7909 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2571 1.5204 -0.9452 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.0625 1.0900 0.1575 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1257 -2.0623 0.3245 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3135 0.8237 -0.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6742 1.6811 -2.4056 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3146 1.5158 -0.4892 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3416 2.3910 0.2032 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1974 -2.9975 -0.6585 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3934 -2.0718 0.9065 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3008 1.5705 0.5279 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3000 -0.5657 0.0068 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7360 1.8243 0.1578 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7470 -3.9423 -1.0595 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3378 -3.0168 0.5055 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2746 0.9279 1.2925 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2738 -1.2084 0.7712 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0147 -3.9520 -0.4775 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1791 0.9784 1.1746 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5846 2.1451 -0.9017 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2611 -0.4614 1.4142 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4707 0.4536 1.1322 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8762 1.6204 -0.9443 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3192 0.7747 0.0726 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9666 -0.5968 1.1026 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6738 0.0428 -1.0891 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8800 -1.4293 0.7919 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6752 -0.8031 1.8525 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1073 2.5250 -0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7865 0.1120 -1.5284 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3277 1.4333 1.3488 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6120 2.2408 -2.4901 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9050 2.2172 -2.9723 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8214 0.7079 -2.8881 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0644 2.5867 1.2462 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3186 3.3717 -0.2893 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6612 -1.3507 1.6742 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3235 2.6534 0.4394 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5546 -1.1747 -0.4952 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5138 -4.6789 -1.8242 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3251 -3.0234 0.9582 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0437 1.5094 1.7925 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2657 -2.2906 0.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7504 -4.6874 -0.7899 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5252 0.7204 2.0036 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2505 2.8015 -1.7009 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0198 -0.9619 2.0087 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7494 -0.1973 1.9537 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5326 1.8734 -1.7725 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9968 -0.9124 0.9077 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3543 -1.5046 1.1322 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9705 -0.0671 2.0612 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 2 10 2 0 0 0 0 3 14 2 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 14 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 7 33 1 0 0 0 0 8 11 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 9 36 1 0 0 0 0 11 16 1 0 0 0 0 11 17 2 0 0 0 0 12 18 2 0 0 0 0 12 19 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 15 20 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 21 2 0 0 0 0 17 22 1 0 0 0 0 17 44 1 0 0 0 0 18 23 1 0 0 0 0 18 45 1 0 0 0 0 19 24 2 0 0 0 0 19 46 1 0 0 0 0 20 26 2 0 0 0 0 20 27 1 0 0 0 0 21 25 1 0 0 0 0 21 47 1 0 0 0 0 22 25 2 0 0 0 0 22 48 1 0 0 0 0 23 28 2 0 0 0 0 23 49 1 0 0 0 0 24 28 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 26 29 1 0 0 0 0 26 52 1 0 0 0 0 27 30 2 0 0 0 0 27 53 1 0 0 0 0 28 54 1 0 0 0 0 29 31 2 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 M END $$$$