BPQZ97 -OEChem-04022105443D 29 30 0 1 0 0 0 0 0999 V2000 1.8989 -1.9313 0.9809 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6234 -1.3282 -0.2826 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7675 -0.3824 -0.6576 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7202 0.8841 0.1918 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4203 1.6455 -0.0594 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1959 0.7651 -0.0334 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2883 -0.6324 -0.1761 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0683 1.3647 0.0768 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8866 -1.4015 -0.1792 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 -0.7941 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2268 0.5887 0.0676 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2234 2.8480 0.1964 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3734 -1.6263 -0.0664 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5735 -2.1297 -1.0285 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6961 -0.1105 -1.7181 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7312 -0.8818 -0.5048 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5738 1.5284 -0.0474 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8055 0.6272 1.2549 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4740 2.1288 -1.0431 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3498 2.4331 0.6991 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8184 -2.4831 -0.2777 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2039 1.0580 0.1552 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6996 3.3615 -0.6164 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2736 3.1549 0.1374 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8358 3.1958 1.1594 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6094 -1.3311 1.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7416 -1.7427 -1.0905 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1842 -2.6201 0.3536 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1619 -1.1680 0.5403 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 3 15 1 0 0 0 0 3 16 1 0 0 0 0 4 5 1 0 0 0 0 4 17 1 0 0 0 0 4 18 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 8 2 0 0 0 0 7 9 2 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 21 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 22 1 0 0 0 0 12 23 1 0 0 0 0 12 24 1 0 0 0 0 12 25 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 13 29 1 0 0 0 0 M END $$$$