BP53DZ -OEChem-04022110433D 40 40 0 1 0 0 0 0 0999 V2000 3.5157 -2.2011 -0.8546 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1895 -0.5364 1.6261 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1921 -3.4638 -0.6603 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9109 2.6232 -0.7057 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0393 -0.7393 -0.3784 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2686 0.7306 0.4894 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3881 -3.4986 1.3005 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1362 -1.3811 0.1624 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3908 -1.0869 -0.6678 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2412 0.2668 -0.4083 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.9788 0.2721 -0.3759 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1179 -0.3660 0.4106 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8572 -2.8768 0.1898 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7928 -0.6563 -1.4976 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9379 0.4161 0.6265 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5633 1.3840 -1.1085 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4816 1.6721 0.8965 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1068 2.6398 -0.8386 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0187 1.8747 0.2621 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0661 2.7839 0.1639 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0043 2.1429 1.3678 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2703 -1.0306 1.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1606 -1.8449 -0.4685 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1778 -1.1739 -1.7419 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8115 1.1494 -0.9008 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0752 -0.5819 -1.3807 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0171 -0.9323 -2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5801 -0.1403 -2.0584 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4594 0.1786 1.3211 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2678 -0.4422 1.2058 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8168 1.2852 -1.8921 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2279 1.7844 1.6776 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7832 3.5056 -1.4088 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9332 -3.0009 1.9972 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2612 -4.4941 1.4494 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4891 3.7618 0.3741 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8837 -2.7020 -2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5887 1.2429 1.5796 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6877 2.9417 1.0668 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4670 2.4496 2.2694 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 37 1 0 0 0 0 2 12 2 0 0 0 0 3 13 2 0 0 0 0 4 19 2 0 0 0 0 5 8 1 0 0 0 0 5 12 1 0 0 0 0 5 26 1 0 0 0 0 6 10 1 0 0 0 0 6 19 1 0 0 0 0 6 29 1 0 0 0 0 7 13 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 22 1 0 0 0 0 9 11 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 12 1 0 0 0 0 10 14 1 0 0 0 0 10 25 1 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 15 17 1 0 0 0 0 15 30 1 0 0 0 0 16 18 2 0 0 0 0 16 31 1 0 0 0 0 17 20 2 0 0 0 0 17 32 1 0 0 0 0 18 20 1 0 0 0 0 18 33 1 0 0 0 0 19 21 1 0 0 0 0 20 36 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 M END $$$$