BHU4O2 -OEChem-04022101202D 45 48 0 0 0 0 0 0 0999 V2000 7.9244 -1.0304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -4.2090 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 -0.4923 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1851 4.7984 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -2.5996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -1.6491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.9043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.9043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 -1.4428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -3.4043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.4043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.4043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.9043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.9043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 -0.2861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5673 0.6644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2101 2.3592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8994 1.4087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5458 0.8706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5422 3.1035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1886 2.5655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8564 1.8212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5637 2.8973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8529 4.0541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8959 3.6416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2066 4.5922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9684 -1.0294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3751 -1.5617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9880 -2.0625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5812 -1.5302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 -3.4043 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 -4.7984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.7843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.0243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8640 -0.0309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.5943 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.2143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2928 1.2809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9598 0.4092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3812 3.1548 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4631 1.9490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3711 2.3080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4596 4.1819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2892 3.5138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7925 5.0536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 8 1 0 0 0 0 2 10 1 0 0 0 0 2 32 1 0 0 0 0 3 9 1 0 0 0 0 3 15 1 0 0 0 0 3 35 1 0 0 0 0 4 24 1 0 0 0 0 4 26 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 2 0 0 0 0 6 9 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 11 2 0 0 0 0 8 12 2 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 31 1 0 0 0 0 11 13 1 0 0 0 0 11 33 1 0 0 0 0 12 14 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 16 18 1 0 0 0 0 16 19 2 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 17 21 1 0 0 0 0 18 38 1 0 0 0 0 19 22 1 0 0 0 0 19 39 1 0 0 0 0 20 23 1 0 0 0 0 20 24 2 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 23 25 2 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 M END $$$$