BX5DY4 -OEChem-04012113162D 89 90 0 1 0 0 0 0 0999 V2000 5.4641 -2.5950 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 8.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 8.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 7.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 7.4050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4641 -2.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 -2.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -8.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -8.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.9050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.5950 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 7.1962 6.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 5.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 5.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 4.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 4.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 7.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 7.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 7.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -5.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -6.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -7.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -5.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -5.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -6.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -8.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -6.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -7.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -8.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 6.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1181 6.4876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7196 5.7973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6728 5.7973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2742 6.4876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 4.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7196 5.0127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1181 4.3224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2742 4.3224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6728 5.0127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 7.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 3.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 9.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 9.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 -3.5124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 -4.2027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 -5.6776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 -4.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -5.0124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -5.7027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -7.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -6.4873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9407 -4.2027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5422 -3.5124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -6.4750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 1.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7196 -4.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1181 -5.6776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8067 -5.7027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4082 -5.0124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 0.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 0.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5856 -6.4873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9841 -7.1776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -8.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -8.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -8.0950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -6.0581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -6.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -7.1319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -1.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6728 -7.2027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2742 -6.5124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -9.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 2 0 0 0 0 1 8 2 0 0 0 0 1 12 1 0 0 0 0 1 40 1 0 0 0 0 2 20 2 0 0 0 0 3 21 1 0 0 0 0 3 56 1 0 0 0 0 4 22 1 0 0 0 0 4 57 1 0 0 0 0 5 21 2 0 0 0 0 6 22 2 0 0 0 0 9 43 1 0 0 0 0 9 89 1 0 0 0 0 10 43 2 0 0 0 0 11 20 1 0 0 0 0 11 23 1 0 0 0 0 11 55 1 0 0 0 0 12 24 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 13 44 1 0 0 0 0 14 17 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 18 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 20 1 0 0 0 0 16 49 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 19 54 1 0 0 0 0 23 29 2 0 0 0 0 23 30 1 0 0 0 0 24 25 1 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 25 26 1 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 26 27 1 0 0 0 0 26 62 1 0 0 0 0 26 63 1 0 0 0 0 27 31 1 0 0 0 0 27 64 1 0 0 0 0 27 65 1 0 0 0 0 28 32 1 0 0 0 0 28 66 1 0 0 0 0 28 67 1 0 0 0 0 29 35 1 0 0 0 0 29 69 1 0 0 0 0 30 36 2 0 0 0 0 30 70 1 0 0 0 0 31 38 1 0 0 0 0 31 39 1 0 0 0 0 31 68 1 0 0 0 0 32 33 1 0 0 0 0 32 71 1 0 0 0 0 32 72 1 0 0 0 0 33 37 1 0 0 0 0 33 73 1 0 0 0 0 33 74 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 34 41 1 0 0 0 0 35 75 1 0 0 0 0 36 76 1 0 0 0 0 37 42 1 0 0 0 0 37 77 1 0 0 0 0 37 78 1 0 0 0 0 38 79 1 0 0 0 0 38 80 1 0 0 0 0 38 81 1 0 0 0 0 39 82 1 0 0 0 0 39 83 1 0 0 0 0 39 84 1 0 0 0 0 40 41 2 0 0 0 0 40 85 1 0 0 0 0 41 86 1 0 0 0 0 42 43 1 0 0 0 0 42 87 1 0 0 0 0 42 88 1 0 0 0 0 M END $$$$