BK9EH8 -OEChem-04012119022D 42 45 0 0 0 0 0 0 0999 V2000 4.6783 1.6320 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5673 -1.6320 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 0.4753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 -0.4753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 0.6815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 -0.6815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.9367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5135 -1.9367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.9367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5135 -2.9367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 2.4367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9837 -2.4367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 3.2415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5673 -3.2415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.4367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3795 -1.4367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.4367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3795 -3.4367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.9367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2455 -1.9367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.9367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2455 -2.9367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5812 0.5626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9880 1.0949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6643 -0.5626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2575 -1.0949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3751 0.5941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9684 0.0618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8704 -0.5941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2772 -0.0618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 2.4367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3637 -2.4367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 3.8308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3747 -3.8308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.8167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3795 -0.8167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.0567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3795 -4.0567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 1.6267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7825 -1.6267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 3.2467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7825 -3.2467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 7 1 0 0 0 0 1 11 1 0 0 0 0 2 6 1 0 0 0 0 2 8 1 0 0 0 0 2 12 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 23 1 0 0 0 0 3 24 1 0 0 0 0 4 6 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 9 1 0 0 0 0 7 15 2 0 0 0 0 8 10 1 0 0 0 0 8 16 2 0 0 0 0 9 13 1 0 0 0 0 9 17 2 0 0 0 0 10 14 1 0 0 0 0 10 18 2 0 0 0 0 11 13 2 0 0 0 0 11 31 1 0 0 0 0 12 14 2 0 0 0 0 12 32 1 0 0 0 0 13 33 1 0 0 0 0 14 34 1 0 0 0 0 15 19 1 0 0 0 0 15 35 1 0 0 0 0 16 20 1 0 0 0 0 16 36 1 0 0 0 0 17 21 1 0 0 0 0 17 37 1 0 0 0 0 18 22 1 0 0 0 0 18 38 1 0 0 0 0 19 21 2 0 0 0 0 19 39 1 0 0 0 0 20 22 2 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 M END $$$$