%VERSION VERSION_STAMP = V0001.000 DATE = 11/12/16 15:47:52 %FLAG TITLE %FORMAT(20a4) Topology produced by mdgx %FLAG POINTERS %FORMAT(10I8) 2448 3 1836 0 0 0 0 0 0 0 2448 612 0 0 0 2 0 0 2 1 0 0 0 0 0 0 0 1 3 0 612 %FLAG ATOM_NAME %FORMAT(20a4) O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 EPW O H1 H2 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1.60000000E+01 1.00800000E+00 1.00800000E+00 0.00000000E+00 1.60000000E+01 1.00800000E+00 1.00800000E+00 0.00000000E+00 1.60000000E+01 1.00800000E+00 1.00800000E+00 0.00000000E+00 1.60000000E+01 1.00800000E+00 1.00800000E+00 0.00000000E+00 1.60000000E+01 1.00800000E+00 1.00800000E+00 0.00000000E+00 1.60000000E+01 1.00800000E+00 1.00800000E+00 0.00000000E+00 1.60000000E+01 1.00800000E+00 1.00800000E+00 0.00000000E+00 1.60000000E+01 1.00800000E+00 1.00800000E+00 0.00000000E+00 1.60000000E+01 1.00800000E+00 1.00800000E+00 0.00000000E+00 1.60000000E+01 1.00800000E+00 1.00800000E+00 0.00000000E+00 1.60000000E+01 1.00800000E+00 1.00800000E+00 0.00000000E+00 1.60000000E+01 1.00800000E+00 1.00800000E+00 0.00000000E+00 1.60000000E+01 1.00800000E+00 1.00800000E+00 0.00000000E+00 1.60000000E+01 1.00800000E+00 1.00800000E+00 0.00000000E+00 1.60000000E+01 1.00800000E+00 1.00800000E+00 0.00000000E+00 1.60000000E+01 1.00800000E+00 1.00800000E+00 0.00000000E+00 1.60000000E+01 1.00800000E+00 1.00800000E+00 0.00000000E+00 1.60000000E+01 1.00800000E+00 1.00800000E+00 0.00000000E+00 1.60000000E+01 1.00800000E+00 1.00800000E+00 0.00000000E+00 1.60000000E+01 1.00800000E+00 1.00800000E+00 0.00000000E+00 1.60000000E+01 1.00800000E+00 1.00800000E+00 0.00000000E+00 1.60000000E+01 1.00800000E+00 1.00800000E+00 0.00000000E+00 %FLAG ATOM_TYPE_INDEX %FORMAT(10I8) 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 3 2 2 2 %FLAG NUMBER_EXCLUDED_ATOMS %FORMAT(10I8) 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 3 2 1 1 %FLAG NONBONDED_PARM_INDEX %FORMAT(10I8) 1 -1 4 -1 3 5 4 5 6 %FLAG RESIDUE_LABEL %FORMAT(20a4) WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT WAT %FLAG RESIDUE_POINTER %FORMAT(10I8) 1 5 9 13 17 21 25 29 33 37 41 45 49 53 57 61 65 69 73 77 81 85 89 93 97 101 105 109 113 117 121 125 129 133 137 141 145 149 153 157 161 165 169 173 177 181 185 189 193 197 201 205 209 213 217 221 225 229 233 237 241 245 249 253 257 261 265 269 273 277 281 285 289 293 297 301 305 309 313 317 321 325 329 333 337 341 345 349 353 357 361 365 369 373 377 381 385 389 393 397 401 405 409 413 417 421 425 429 433 437 441 445 449 453 457 461 465 469 473 477 481 485 489 493 497 501 505 509 513 517 521 525 529 533 537 541 545 549 553 557 561 565 569 573 577 581 585 589 593 597 601 605 609 613 617 621 625 629 633 637 641 645 649 653 657 661 665 669 673 677 681 685 689 693 697 701 705 709 713 717 721 725 729 733 737 741 745 749 753 757 761 765 769 773 777 781 785 789 793 797 801 805 809 813 817 821 825 829 833 837 841 845 849 853 857 861 865 869 873 877 881 885 889 893 897 901 905 909 913 917 921 925 929 933 937 941 945 949 953 957 961 965 969 973 977 981 985 989 993 997 1001 1005 1009 1013 1017 1021 1025 1029 1033 1037 1041 1045 1049 1053 1057 1061 1065 1069 1073 1077 1081 1085 1089 1093 1097 1101 1105 1109 1113 1117 1121 1125 1129 1133 1137 1141 1145 1149 1153 1157 1161 1165 1169 1173 1177 1181 1185 1189 1193 1197 1201 1205 1209 1213 1217 1221 1225 1229 1233 1237 1241 1245 1249 1253 1257 1261 1265 1269 1273 1277 1281 1285 1289 1293 1297 1301 1305 1309 1313 1317 1321 1325 1329 1333 1337 1341 1345 1349 1353 1357 1361 1365 1369 1373 1377 1381 1385 1389 1393 1397 1401 1405 1409 1413 1417 1421 1425 1429 1433 1437 1441 1445 1449 1453 1457 1461 1465 1469 1473 1477 1481 1485 1489 1493 1497 1501 1505 1509 1513 1517 1521 1525 1529 1533 1537 1541 1545 1549 1553 1557 1561 1565 1569 1573 1577 1581 1585 1589 1593 1597 1601 1605 1609 1613 1617 1621 1625 1629 1633 1637 1641 1645 1649 1653 1657 1661 1665 1669 1673 1677 1681 1685 1689 1693 1697 1701 1705 1709 1713 1717 1721 1725 1729 1733 1737 1741 1745 1749 1753 1757 1761 1765 1769 1773 1777 1781 1785 1789 1793 1797 1801 1805 1809 1813 1817 1821 1825 1829 1833 1837 1841 1845 1849 1853 1857 1861 1865 1869 1873 1877 1881 1885 1889 1893 1897 1901 1905 1909 1913 1917 1921 1925 1929 1933 1937 1941 1945 1949 1953 1957 1961 1965 1969 1973 1977 1981 1985 1989 1993 1997 2001 2005 2009 2013 2017 2021 2025 2029 2033 2037 2041 2045 2049 2053 2057 2061 2065 2069 2073 2077 2081 2085 2089 2093 2097 2101 2105 2109 2113 2117 2121 2125 2129 2133 2137 2141 2145 2149 2153 2157 2161 2165 2169 2173 2177 2181 2185 2189 2193 2197 2201 2205 2209 2213 2217 2221 2225 2229 2233 2237 2241 2245 2249 2253 2257 2261 2265 2269 2273 2277 2281 2285 2289 2293 2297 2301 2305 2309 2313 2317 2321 2325 2329 2333 2337 2341 2345 2349 2353 2357 2361 2365 2369 2373 2377 2381 2385 2389 2393 2397 2401 2405 2409 2413 2417 2421 2425 2429 2433 2437 2441 2445 %FLAG BOND_FORCE_CONSTANT %FORMAT(5E16.8) 5.53000000E+02 5.53000000E+02 %FLAG BOND_EQUIL_VALUE %FORMAT(5E16.8) 1.51360000E+00 9.57200000E-01 %FLAG ANGLE_FORCE_CONSTANT %FORMAT(5E16.8) %FLAG ANGLE_EQUIL_VALUE %FORMAT(5E16.8) %FLAG DIHEDRAL_FORCE_CONSTANT %FORMAT(5E16.8) %FLAG DIHEDRAL_PERIODICITY %FORMAT(5E16.8) %FLAG DIHEDRAL_PHASE %FORMAT(5E16.8) %FLAG SCEE_SCALE_FACTOR %FORMAT(5E16.8) %FLAG SCNB_SCALE_FACTOR %FORMAT(5E16.8) %FLAG SOLTY %FORMAT(5E16.8) 0.00000000E+00 0.00000000E+00 %FLAG LENNARD_JONES_ACOEF %FORMAT(5E16.8) 5.81935564E+05 0.00000000E+00 0.00000000E+00 6.17939961E+05 0.00000000E+00 6.56135453E+05 %FLAG LENNARD_JONES_BCOEF %FORMAT(5E16.8) 5.94825035E+02 0.00000000E+00 0.00000000E+00 6.23511233E+02 0.00000000E+00 6.53562683E+02 %FLAG BONDS_INC_HYDROGEN %FORMAT(10I8) 3 6 1 0 3 2 0 6 2 15 12 2 18 12 2 18 15 1 27 24 2 30 24 2 30 27 1 39 36 2 42 36 2 42 39 1 51 48 2 54 48 2 54 51 1 63 60 2 66 60 2 66 63 1 75 72 2 78 72 2 78 75 1 87 84 2 90 84 2 90 87 1 99 96 2 102 96 2 102 99 1 111 108 2 114 108 2 114 111 1 123 120 2 126 120 2 126 123 1 135 132 2 138 132 2 138 135 1 147 144 2 150 144 2 150 147 1 159 156 2 162 156 2 162 159 1 171 168 2 174 168 2 174 171 1 183 180 2 186 180 2 186 183 1 195 192 2 198 192 2 198 195 1 207 204 2 210 204 2 210 207 1 219 216 2 222 216 2 222 219 1 231 228 2 234 228 2 234 231 1 243 240 2 246 240 2 246 243 1 255 252 2 258 252 2 258 255 1 267 264 2 270 264 2 270 267 1 279 276 2 282 276 2 282 279 1 291 288 2 294 288 2 294 291 1 303 300 2 306 300 2 306 303 1 315 312 2 318 312 2 318 315 1 327 324 2 330 324 2 330 327 1 339 336 2 342 336 2 342 339 1 351 348 2 354 348 2 354 351 1 363 360 2 366 360 2 366 363 1 375 372 2 378 372 2 378 375 1 387 384 2 390 384 2 390 387 1 399 396 2 402 396 2 402 399 1 411 408 2 414 408 2 414 411 1 423 420 2 426 420 2 426 423 1 435 432 2 438 432 2 438 435 1 447 444 2 450 444 2 450 447 1 459 456 2 462 456 2 462 459 1 471 468 2 474 468 2 474 471 1 483 480 2 486 480 2 486 483 1 495 492 2 498 492 2 498 495 1 507 504 2 510 504 2 510 507 1 519 516 2 522 516 2 522 519 1 531 528 2 534 528 2 534 531 1 543 540 2 546 540 2 546 543 1 555 552 2 558 552 2 558 555 1 567 564 2 570 564 2 570 567 1 579 576 2 582 576 2 582 579 1 591 588 2 594 588 2 594 591 1 603 600 2 606 600 2 606 603 1 615 612 2 618 612 2 618 615 1 627 624 2 630 624 2 630 627 1 639 636 2 642 636 2 642 639 1 651 648 2 654 648 2 654 651 1 663 660 2 666 660 2 666 663 1 675 672 2 678 672 2 678 675 1 687 684 2 690 684 2 690 687 1 699 696 2 702 696 2 702 699 1 711 708 2 714 708 2 714 711 1 723 720 2 726 720 2 726 723 1 735 732 2 738 732 2 738 735 1 747 744 2 750 744 2 750 747 1 759 756 2 762 756 2 762 759 1 771 768 2 774 768 2 774 771 1 783 780 2 786 780 2 786 783 1 795 792 2 798 792 2 798 795 1 807 804 2 810 804 2 810 807 1 819 816 2 822 816 2 822 819 1 831 828 2 834 828 2 834 831 1 843 840 2 846 840 2 846 843 1 855 852 2 858 852 2 858 855 1 867 864 2 870 864 2 870 867 1 879 876 2 882 876 2 882 879 1 891 888 2 894 888 2 894 891 1 903 900 2 906 900 2 906 903 1 915 912 2 918 912 2 918 915 1 927 924 2 930 924 2 930 927 1 939 936 2 942 936 2 942 939 1 951 948 2 954 948 2 954 951 1 963 960 2 966 960 2 966 963 1 975 972 2 978 972 2 978 975 1 987 984 2 990 984 2 990 987 1 999 996 2 1002 996 2 1002 999 1 1011 1008 2 1014 1008 2 1014 1011 1 1023 1020 2 1026 1020 2 1026 1023 1 1035 1032 2 1038 1032 2 1038 1035 1 1047 1044 2 1050 1044 2 1050 1047 1 1059 1056 2 1062 1056 2 1062 1059 1 1071 1068 2 1074 1068 2 1074 1071 1 1083 1080 2 1086 1080 2 1086 1083 1 1095 1092 2 1098 1092 2 1098 1095 1 1107 1104 2 1110 1104 2 1110 1107 1 1119 1116 2 1122 1116 2 1122 1119 1 1131 1128 2 1134 1128 2 1134 1131 1 1143 1140 2 1146 1140 2 1146 1143 1 1155 1152 2 1158 1152 2 1158 1155 1 1167 1164 2 1170 1164 2 1170 1167 1 1179 1176 2 1182 1176 2 1182 1179 1 1191 1188 2 1194 1188 2 1194 1191 1 1203 1200 2 1206 1200 2 1206 1203 1 1215 1212 2 1218 1212 2 1218 1215 1 1227 1224 2 1230 1224 2 1230 1227 1 1239 1236 2 1242 1236 2 1242 1239 1 1251 1248 2 1254 1248 2 1254 1251 1 1263 1260 2 1266 1260 2 1266 1263 1 1275 1272 2 1278 1272 2 1278 1275 1 1287 1284 2 1290 1284 2 1290 1287 1 1299 1296 2 1302 1296 2 1302 1299 1 1311 1308 2 1314 1308 2 1314 1311 1 1323 1320 2 1326 1320 2 1326 1323 1 1335 1332 2 1338 1332 2 1338 1335 1 1347 1344 2 1350 1344 2 1350 1347 1 1359 1356 2 1362 1356 2 1362 1359 1 1371 1368 2 1374 1368 2 1374 1371 1 1383 1380 2 1386 1380 2 1386 1383 1 1395 1392 2 1398 1392 2 1398 1395 1 1407 1404 2 1410 1404 2 1410 1407 1 1419 1416 2 1422 1416 2 1422 1419 1 1431 1428 2 1434 1428 2 1434 1431 1 1443 1440 2 1446 1440 2 1446 1443 1 1455 1452 2 1458 1452 2 1458 1455 1 1467 1464 2 1470 1464 2 1470 1467 1 1479 1476 2 1482 1476 2 1482 1479 1 1491 1488 2 1494 1488 2 1494 1491 1 1503 1500 2 1506 1500 2 1506 1503 1 1515 1512 2 1518 1512 2 1518 1515 1 1527 1524 2 1530 1524 2 1530 1527 1 1539 1536 2 1542 1536 2 1542 1539 1 1551 1548 2 1554 1548 2 1554 1551 1 1563 1560 2 1566 1560 2 1566 1563 1 1575 1572 2 1578 1572 2 1578 1575 1 1587 1584 2 1590 1584 2 1590 1587 1 1599 1596 2 1602 1596 2 1602 1599 1 1611 1608 2 1614 1608 2 1614 1611 1 1623 1620 2 1626 1620 2 1626 1623 1 1635 1632 2 1638 1632 2 1638 1635 1 1647 1644 2 1650 1644 2 1650 1647 1 1659 1656 2 1662 1656 2 1662 1659 1 1671 1668 2 1674 1668 2 1674 1671 1 1683 1680 2 1686 1680 2 1686 1683 1 1695 1692 2 1698 1692 2 1698 1695 1 1707 1704 2 1710 1704 2 1710 1707 1 1719 1716 2 1722 1716 2 1722 1719 1 1731 1728 2 1734 1728 2 1734 1731 1 1743 1740 2 1746 1740 2 1746 1743 1 1755 1752 2 1758 1752 2 1758 1755 1 1767 1764 2 1770 1764 2 1770 1767 1 1779 1776 2 1782 1776 2 1782 1779 1 1791 1788 2 1794 1788 2 1794 1791 1 1803 1800 2 1806 1800 2 1806 1803 1 1815 1812 2 1818 1812 2 1818 1815 1 1827 1824 2 1830 1824 2 1830 1827 1 1839 1836 2 1842 1836 2 1842 1839 1 1851 1848 2 1854 1848 2 1854 1851 1 1863 1860 2 1866 1860 2 1866 1863 1 1875 1872 2 1878 1872 2 1878 1875 1 1887 1884 2 1890 1884 2 1890 1887 1 1899 1896 2 1902 1896 2 1902 1899 1 1911 1908 2 1914 1908 2 1914 1911 1 1923 1920 2 1926 1920 2 1926 1923 1 1935 1932 2 1938 1932 2 1938 1935 1 1947 1944 2 1950 1944 2 1950 1947 1 1959 1956 2 1962 1956 2 1962 1959 1 1971 1968 2 1974 1968 2 1974 1971 1 1983 1980 2 1986 1980 2 1986 1983 1 1995 1992 2 1998 1992 2 1998 1995 1 2007 2004 2 2010 2004 2 2010 2007 1 2019 2016 2 2022 2016 2 2022 2019 1 2031 2028 2 2034 2028 2 2034 2031 1 2043 2040 2 2046 2040 2 2046 2043 1 2055 2052 2 2058 2052 2 2058 2055 1 2067 2064 2 2070 2064 2 2070 2067 1 2079 2076 2 2082 2076 2 2082 2079 1 2091 2088 2 2094 2088 2 2094 2091 1 2103 2100 2 2106 2100 2 2106 2103 1 2115 2112 2 2118 2112 2 2118 2115 1 2127 2124 2 2130 2124 2 2130 2127 1 2139 2136 2 2142 2136 2 2142 2139 1 2151 2148 2 2154 2148 2 2154 2151 1 2163 2160 2 2166 2160 2 2166 2163 1 2175 2172 2 2178 2172 2 2178 2175 1 2187 2184 2 2190 2184 2 2190 2187 1 2199 2196 2 2202 2196 2 2202 2199 1 2211 2208 2 2214 2208 2 2214 2211 1 2223 2220 2 2226 2220 2 2226 2223 1 2235 2232 2 2238 2232 2 2238 2235 1 2247 2244 2 2250 2244 2 2250 2247 1 2259 2256 2 2262 2256 2 2262 2259 1 2271 2268 2 2274 2268 2 2274 2271 1 2283 2280 2 2286 2280 2 2286 2283 1 2295 2292 2 2298 2292 2 2298 2295 1 2307 2304 2 2310 2304 2 2310 2307 1 2319 2316 2 2322 2316 2 2322 2319 1 2331 2328 2 2334 2328 2 2334 2331 1 2343 2340 2 2346 2340 2 2346 2343 1 2355 2352 2 2358 2352 2 2358 2355 1 2367 2364 2 2370 2364 2 2370 2367 1 2379 2376 2 2382 2376 2 2382 2379 1 2391 2388 2 2394 2388 2 2394 2391 1 2403 2400 2 2406 2400 2 2406 2403 1 2415 2412 2 2418 2412 2 2418 2415 1 2427 2424 2 2430 2424 2 2430 2427 1 2439 2436 2 2442 2436 2 2442 2439 1 2451 2448 2 2454 2448 2 2454 2451 1 2463 2460 2 2466 2460 2 2466 2463 1 2475 2472 2 2478 2472 2 2478 2475 1 2487 2484 2 2490 2484 2 2490 2487 1 2499 2496 2 2502 2496 2 2502 2499 1 2511 2508 2 2514 2508 2 2514 2511 1 2523 2520 2 2526 2520 2 2526 2523 1 2535 2532 2 2538 2532 2 2538 2535 1 2547 2544 2 2550 2544 2 2550 2547 1 2559 2556 2 2562 2556 2 2562 2559 1 2571 2568 2 2574 2568 2 2574 2571 1 2583 2580 2 2586 2580 2 2586 2583 1 2595 2592 2 2598 2592 2 2598 2595 1 2607 2604 2 2610 2604 2 2610 2607 1 2619 2616 2 2622 2616 2 2622 2619 1 2631 2628 2 2634 2628 2 2634 2631 1 2643 2640 2 2646 2640 2 2646 2643 1 2655 2652 2 2658 2652 2 2658 2655 1 2667 2664 2 2670 2664 2 2670 2667 1 2679 2676 2 2682 2676 2 2682 2679 1 2691 2688 2 2694 2688 2 2694 2691 1 2703 2700 2 2706 2700 2 2706 2703 1 2715 2712 2 2718 2712 2 2718 2715 1 2727 2724 2 2730 2724 2 2730 2727 1 2739 2736 2 2742 2736 2 2742 2739 1 2751 2748 2 2754 2748 2 2754 2751 1 2763 2760 2 2766 2760 2 2766 2763 1 2775 2772 2 2778 2772 2 2778 2775 1 2787 2784 2 2790 2784 2 2790 2787 1 2799 2796 2 2802 2796 2 2802 2799 1 2811 2808 2 2814 2808 2 2814 2811 1 2823 2820 2 2826 2820 2 2826 2823 1 2835 2832 2 2838 2832 2 2838 2835 1 2847 2844 2 2850 2844 2 2850 2847 1 2859 2856 2 2862 2856 2 2862 2859 1 2871 2868 2 2874 2868 2 2874 2871 1 2883 2880 2 2886 2880 2 2886 2883 1 2895 2892 2 2898 2892 2 2898 2895 1 2907 2904 2 2910 2904 2 2910 2907 1 2919 2916 2 2922 2916 2 2922 2919 1 2931 2928 2 2934 2928 2 2934 2931 1 2943 2940 2 2946 2940 2 2946 2943 1 2955 2952 2 2958 2952 2 2958 2955 1 2967 2964 2 2970 2964 2 2970 2967 1 2979 2976 2 2982 2976 2 2982 2979 1 2991 2988 2 2994 2988 2 2994 2991 1 3003 3000 2 3006 3000 2 3006 3003 1 3015 3012 2 3018 3012 2 3018 3015 1 3027 3024 2 3030 3024 2 3030 3027 1 3039 3036 2 3042 3036 2 3042 3039 1 3051 3048 2 3054 3048 2 3054 3051 1 3063 3060 2 3066 3060 2 3066 3063 1 3075 3072 2 3078 3072 2 3078 3075 1 3087 3084 2 3090 3084 2 3090 3087 1 3099 3096 2 3102 3096 2 3102 3099 1 3111 3108 2 3114 3108 2 3114 3111 1 3123 3120 2 3126 3120 2 3126 3123 1 3135 3132 2 3138 3132 2 3138 3135 1 3147 3144 2 3150 3144 2 3150 3147 1 3159 3156 2 3162 3156 2 3162 3159 1 3171 3168 2 3174 3168 2 3174 3171 1 3183 3180 2 3186 3180 2 3186 3183 1 3195 3192 2 3198 3192 2 3198 3195 1 3207 3204 2 3210 3204 2 3210 3207 1 3219 3216 2 3222 3216 2 3222 3219 1 3231 3228 2 3234 3228 2 3234 3231 1 3243 3240 2 3246 3240 2 3246 3243 1 3255 3252 2 3258 3252 2 3258 3255 1 3267 3264 2 3270 3264 2 3270 3267 1 3279 3276 2 3282 3276 2 3282 3279 1 3291 3288 2 3294 3288 2 3294 3291 1 3303 3300 2 3306 3300 2 3306 3303 1 3315 3312 2 3318 3312 2 3318 3315 1 3327 3324 2 3330 3324 2 3330 3327 1 3339 3336 2 3342 3336 2 3342 3339 1 3351 3348 2 3354 3348 2 3354 3351 1 3363 3360 2 3366 3360 2 3366 3363 1 3375 3372 2 3378 3372 2 3378 3375 1 3387 3384 2 3390 3384 2 3390 3387 1 3399 3396 2 3402 3396 2 3402 3399 1 3411 3408 2 3414 3408 2 3414 3411 1 3423 3420 2 3426 3420 2 3426 3423 1 3435 3432 2 3438 3432 2 3438 3435 1 3447 3444 2 3450 3444 2 3450 3447 1 3459 3456 2 3462 3456 2 3462 3459 1 3471 3468 2 3474 3468 2 3474 3471 1 3483 3480 2 3486 3480 2 3486 3483 1 3495 3492 2 3498 3492 2 3498 3495 1 3507 3504 2 3510 3504 2 3510 3507 1 3519 3516 2 3522 3516 2 3522 3519 1 3531 3528 2 3534 3528 2 3534 3531 1 3543 3540 2 3546 3540 2 3546 3543 1 3555 3552 2 3558 3552 2 3558 3555 1 3567 3564 2 3570 3564 2 3570 3567 1 3579 3576 2 3582 3576 2 3582 3579 1 3591 3588 2 3594 3588 2 3594 3591 1 3603 3600 2 3606 3600 2 3606 3603 1 3615 3612 2 3618 3612 2 3618 3615 1 3627 3624 2 3630 3624 2 3630 3627 1 3639 3636 2 3642 3636 2 3642 3639 1 3651 3648 2 3654 3648 2 3654 3651 1 3663 3660 2 3666 3660 2 3666 3663 1 3675 3672 2 3678 3672 2 3678 3675 1 3687 3684 2 3690 3684 2 3690 3687 1 3699 3696 2 3702 3696 2 3702 3699 1 3711 3708 2 3714 3708 2 3714 3711 1 3723 3720 2 3726 3720 2 3726 3723 1 3735 3732 2 3738 3732 2 3738 3735 1 3747 3744 2 3750 3744 2 3750 3747 1 3759 3756 2 3762 3756 2 3762 3759 1 3771 3768 2 3774 3768 2 3774 3771 1 3783 3780 2 3786 3780 2 3786 3783 1 3795 3792 2 3798 3792 2 3798 3795 1 3807 3804 2 3810 3804 2 3810 3807 1 3819 3816 2 3822 3816 2 3822 3819 1 3831 3828 2 3834 3828 2 3834 3831 1 3843 3840 2 3846 3840 2 3846 3843 1 3855 3852 2 3858 3852 2 3858 3855 1 3867 3864 2 3870 3864 2 3870 3867 1 3879 3876 2 3882 3876 2 3882 3879 1 3891 3888 2 3894 3888 2 3894 3891 1 3903 3900 2 3906 3900 2 3906 3903 1 3915 3912 2 3918 3912 2 3918 3915 1 3927 3924 2 3930 3924 2 3930 3927 1 3939 3936 2 3942 3936 2 3942 3939 1 3951 3948 2 3954 3948 2 3954 3951 1 3963 3960 2 3966 3960 2 3966 3963 1 3975 3972 2 3978 3972 2 3978 3975 1 3987 3984 2 3990 3984 2 3990 3987 1 3999 3996 2 4002 3996 2 4002 3999 1 4011 4008 2 4014 4008 2 4014 4011 1 4023 4020 2 4026 4020 2 4026 4023 1 4035 4032 2 4038 4032 2 4038 4035 1 4047 4044 2 4050 4044 2 4050 4047 1 4059 4056 2 4062 4056 2 4062 4059 1 4071 4068 2 4074 4068 2 4074 4071 1 4083 4080 2 4086 4080 2 4086 4083 1 4095 4092 2 4098 4092 2 4098 4095 1 4107 4104 2 4110 4104 2 4110 4107 1 4119 4116 2 4122 4116 2 4122 4119 1 4131 4128 2 4134 4128 2 4134 4131 1 4143 4140 2 4146 4140 2 4146 4143 1 4155 4152 2 4158 4152 2 4158 4155 1 4167 4164 2 4170 4164 2 4170 4167 1 4179 4176 2 4182 4176 2 4182 4179 1 4191 4188 2 4194 4188 2 4194 4191 1 4203 4200 2 4206 4200 2 4206 4203 1 4215 4212 2 4218 4212 2 4218 4215 1 4227 4224 2 4230 4224 2 4230 4227 1 4239 4236 2 4242 4236 2 4242 4239 1 4251 4248 2 4254 4248 2 4254 4251 1 4263 4260 2 4266 4260 2 4266 4263 1 4275 4272 2 4278 4272 2 4278 4275 1 4287 4284 2 4290 4284 2 4290 4287 1 4299 4296 2 4302 4296 2 4302 4299 1 4311 4308 2 4314 4308 2 4314 4311 1 4323 4320 2 4326 4320 2 4326 4323 1 4335 4332 2 4338 4332 2 4338 4335 1 4347 4344 2 4350 4344 2 4350 4347 1 4359 4356 2 4362 4356 2 4362 4359 1 4371 4368 2 4374 4368 2 4374 4371 1 4383 4380 2 4386 4380 2 4386 4383 1 4395 4392 2 4398 4392 2 4398 4395 1 4407 4404 2 4410 4404 2 4410 4407 1 4419 4416 2 4422 4416 2 4422 4419 1 4431 4428 2 4434 4428 2 4434 4431 1 4443 4440 2 4446 4440 2 4446 4443 1 4455 4452 2 4458 4452 2 4458 4455 1 4467 4464 2 4470 4464 2 4470 4467 1 4479 4476 2 4482 4476 2 4482 4479 1 4491 4488 2 4494 4488 2 4494 4491 1 4503 4500 2 4506 4500 2 4506 4503 1 4515 4512 2 4518 4512 2 4518 4515 1 4527 4524 2 4530 4524 2 4530 4527 1 4539 4536 2 4542 4536 2 4542 4539 1 4551 4548 2 4554 4548 2 4554 4551 1 4563 4560 2 4566 4560 2 4566 4563 1 4575 4572 2 4578 4572 2 4578 4575 1 4587 4584 2 4590 4584 2 4590 4587 1 4599 4596 2 4602 4596 2 4602 4599 1 4611 4608 2 4614 4608 2 4614 4611 1 4623 4620 2 4626 4620 2 4626 4623 1 4635 4632 2 4638 4632 2 4638 4635 1 4647 4644 2 4650 4644 2 4650 4647 1 4659 4656 2 4662 4656 2 4662 4659 1 4671 4668 2 4674 4668 2 4674 4671 1 4683 4680 2 4686 4680 2 4686 4683 1 4695 4692 2 4698 4692 2 4698 4695 1 4707 4704 2 4710 4704 2 4710 4707 1 4719 4716 2 4722 4716 2 4722 4719 1 4731 4728 2 4734 4728 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1695 1696 1696 0 1698 1699 1700 1699 1700 1700 0 1702 1703 1704 1703 1704 1704 0 1706 1707 1708 1707 1708 1708 0 1710 1711 1712 1711 1712 1712 0 1714 1715 1716 1715 1716 1716 0 1718 1719 1720 1719 1720 1720 0 1722 1723 1724 1723 1724 1724 0 1726 1727 1728 1727 1728 1728 0 1730 1731 1732 1731 1732 1732 0 1734 1735 1736 1735 1736 1736 0 1738 1739 1740 1739 1740 1740 0 1742 1743 1744 1743 1744 1744 0 1746 1747 1748 1747 1748 1748 0 1750 1751 1752 1751 1752 1752 0 1754 1755 1756 1755 1756 1756 0 1758 1759 1760 1759 1760 1760 0 1762 1763 1764 1763 1764 1764 0 1766 1767 1768 1767 1768 1768 0 1770 1771 1772 1771 1772 1772 0 1774 1775 1776 1775 1776 1776 0 1778 1779 1780 1779 1780 1780 0 1782 1783 1784 1783 1784 1784 0 1786 1787 1788 1787 1788 1788 0 1790 1791 1792 1791 1792 1792 0 1794 1795 1796 1795 1796 1796 0 1798 1799 1800 1799 1800 1800 0 1802 1803 1804 1803 1804 1804 0 1806 1807 1808 1807 1808 1808 0 1810 1811 1812 1811 1812 1812 0 1814 1815 1816 1815 1816 1816 0 1818 1819 1820 1819 1820 1820 0 1822 1823 1824 1823 1824 1824 0 1826 1827 1828 1827 1828 1828 0 1830 1831 1832 1831 1832 1832 0 1834 1835 1836 1835 1836 1836 0 1838 1839 1840 1839 1840 1840 0 1842 1843 1844 1843 1844 1844 0 1846 1847 1848 1847 1848 1848 0 1850 1851 1852 1851 1852 1852 0 1854 1855 1856 1855 1856 1856 0 1858 1859 1860 1859 1860 1860 0 1862 1863 1864 1863 1864 1864 0 1866 1867 1868 1867 1868 1868 0 1870 1871 1872 1871 1872 1872 0 1874 1875 1876 1875 1876 1876 0 1878 1879 1880 1879 1880 1880 0 1882 1883 1884 1883 1884 1884 0 1886 1887 1888 1887 1888 1888 0 1890 1891 1892 1891 1892 1892 0 1894 1895 1896 1895 1896 1896 0 1898 1899 1900 1899 1900 1900 0 1902 1903 1904 1903 1904 1904 0 1906 1907 1908 1907 1908 1908 0 1910 1911 1912 1911 1912 1912 0 1914 1915 1916 1915 1916 1916 0 1918 1919 1920 1919 1920 1920 0 1922 1923 1924 1923 1924 1924 0 1926 1927 1928 1927 1928 1928 0 1930 1931 1932 1931 1932 1932 0 1934 1935 1936 1935 1936 1936 0 1938 1939 1940 1939 1940 1940 0 1942 1943 1944 1943 1944 1944 0 1946 1947 1948 1947 1948 1948 0 1950 1951 1952 1951 1952 1952 0 1954 1955 1956 1955 1956 1956 0 1958 1959 1960 1959 1960 1960 0 1962 1963 1964 1963 1964 1964 0 1966 1967 1968 1967 1968 1968 0 1970 1971 1972 1971 1972 1972 0 1974 1975 1976 1975 1976 1976 0 1978 1979 1980 1979 1980 1980 0 1982 1983 1984 1983 1984 1984 0 1986 1987 1988 1987 1988 1988 0 1990 1991 1992 1991 1992 1992 0 1994 1995 1996 1995 1996 1996 0 1998 1999 2000 1999 2000 2000 0 2002 2003 2004 2003 2004 2004 0 2006 2007 2008 2007 2008 2008 0 2010 2011 2012 2011 2012 2012 0 2014 2015 2016 2015 2016 2016 0 2018 2019 2020 2019 2020 2020 0 2022 2023 2024 2023 2024 2024 0 2026 2027 2028 2027 2028 2028 0 2030 2031 2032 2031 2032 2032 0 2034 2035 2036 2035 2036 2036 0 2038 2039 2040 2039 2040 2040 0 2042 2043 2044 2043 2044 2044 0 2046 2047 2048 2047 2048 2048 0 2050 2051 2052 2051 2052 2052 0 2054 2055 2056 2055 2056 2056 0 2058 2059 2060 2059 2060 2060 0 2062 2063 2064 2063 2064 2064 0 2066 2067 2068 2067 2068 2068 0 2070 2071 2072 2071 2072 2072 0 2074 2075 2076 2075 2076 2076 0 2078 2079 2080 2079 2080 2080 0 2082 2083 2084 2083 2084 2084 0 2086 2087 2088 2087 2088 2088 0 2090 2091 2092 2091 2092 2092 0 2094 2095 2096 2095 2096 2096 0 2098 2099 2100 2099 2100 2100 0 2102 2103 2104 2103 2104 2104 0 2106 2107 2108 2107 2108 2108 0 2110 2111 2112 2111 2112 2112 0 2114 2115 2116 2115 2116 2116 0 2118 2119 2120 2119 2120 2120 0 2122 2123 2124 2123 2124 2124 0 2126 2127 2128 2127 2128 2128 0 2130 2131 2132 2131 2132 2132 0 2134 2135 2136 2135 2136 2136 0 2138 2139 2140 2139 2140 2140 0 2142 2143 2144 2143 2144 2144 0 2146 2147 2148 2147 2148 2148 0 2150 2151 2152 2151 2152 2152 0 2154 2155 2156 2155 2156 2156 0 2158 2159 2160 2159 2160 2160 0 2162 2163 2164 2163 2164 2164 0 2166 2167 2168 2167 2168 2168 0 2170 2171 2172 2171 2172 2172 0 2174 2175 2176 2175 2176 2176 0 2178 2179 2180 2179 2180 2180 0 2182 2183 2184 2183 2184 2184 0 2186 2187 2188 2187 2188 2188 0 2190 2191 2192 2191 2192 2192 0 2194 2195 2196 2195 2196 2196 0 2198 2199 2200 2199 2200 2200 0 2202 2203 2204 2203 2204 2204 0 2206 2207 2208 2207 2208 2208 0 2210 2211 2212 2211 2212 2212 0 2214 2215 2216 2215 2216 2216 0 2218 2219 2220 2219 2220 2220 0 2222 2223 2224 2223 2224 2224 0 2226 2227 2228 2227 2228 2228 0 2230 2231 2232 2231 2232 2232 0 2234 2235 2236 2235 2236 2236 0 2238 2239 2240 2239 2240 2240 0 2242 2243 2244 2243 2244 2244 0 2246 2247 2248 2247 2248 2248 0 2250 2251 2252 2251 2252 2252 0 2254 2255 2256 2255 2256 2256 0 2258 2259 2260 2259 2260 2260 0 2262 2263 2264 2263 2264 2264 0 2266 2267 2268 2267 2268 2268 0 2270 2271 2272 2271 2272 2272 0 2274 2275 2276 2275 2276 2276 0 2278 2279 2280 2279 2280 2280 0 2282 2283 2284 2283 2284 2284 0 2286 2287 2288 2287 2288 2288 0 2290 2291 2292 2291 2292 2292 0 2294 2295 2296 2295 2296 2296 0 2298 2299 2300 2299 2300 2300 0 2302 2303 2304 2303 2304 2304 0 2306 2307 2308 2307 2308 2308 0 2310 2311 2312 2311 2312 2312 0 2314 2315 2316 2315 2316 2316 0 2318 2319 2320 2319 2320 2320 0 2322 2323 2324 2323 2324 2324 0 2326 2327 2328 2327 2328 2328 0 2330 2331 2332 2331 2332 2332 0 2334 2335 2336 2335 2336 2336 0 2338 2339 2340 2339 2340 2340 0 2342 2343 2344 2343 2344 2344 0 2346 2347 2348 2347 2348 2348 0 2350 2351 2352 2351 2352 2352 0 2354 2355 2356 2355 2356 2356 0 2358 2359 2360 2359 2360 2360 0 2362 2363 2364 2363 2364 2364 0 2366 2367 2368 2367 2368 2368 0 2370 2371 2372 2371 2372 2372 0 2374 2375 2376 2375 2376 2376 0 2378 2379 2380 2379 2380 2380 0 2382 2383 2384 2383 2384 2384 0 2386 2387 2388 2387 2388 2388 0 2390 2391 2392 2391 2392 2392 0 2394 2395 2396 2395 2396 2396 0 2398 2399 2400 2399 2400 2400 0 2402 2403 2404 2403 2404 2404 0 2406 2407 2408 2407 2408 2408 0 2410 2411 2412 2411 2412 2412 0 2414 2415 2416 2415 2416 2416 0 2418 2419 2420 2419 2420 2420 0 2422 2423 2424 2423 2424 2424 0 2426 2427 2428 2427 2428 2428 0 2430 2431 2432 2431 2432 2432 0 2434 2435 2436 2435 2436 2436 0 2438 2439 2440 2439 2440 2440 0 2442 2443 2444 2443 2444 2444 0 2446 2447 2448 2447 2448 2448 0 %FLAG HBOND_ACOEF %FORMAT(5E16.8) 0.00000000E+00 %FLAG HBOND_BCOEF %FORMAT(5E16.8) 0.00000000E+00 %FLAG HBCUT %FORMAT(5E16.8) 0.00000000E+00 %FLAG AMBER_ATOM_TYPE %FORMAT(20a4) OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP OW HW HW EP %FLAG TREE_CHAIN_CLASSIFICATION %FORMAT(20a4) BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA BLA 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0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 %FLAG SOLVENT_POINTERS %FORMAT(3I8) 0 612 1 %FLAG ATOMS_PER_MOLECULE %FORMAT(10I8) 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 4 %FLAG BOX_DIMENSIONS %FORMAT(5E16.8) 9.00000000E+01 1.12305624E+02 1.13387982E+02 1.13319345E+02 %FLAG RADIUS_SET %FORMAT(1a80) modified Bondi radii (mbondi) %FLAG RADII %FORMAT(5E16.8) 1.50000000E+00 8.00000000E-01 8.00000000E-01 0.00000000E+00 1.50000000E+00 8.00000000E-01 8.00000000E-01 0.00000000E+00 1.50000000E+00 8.00000000E-01 8.00000000E-01 0.00000000E+00 1.50000000E+00 8.00000000E-01 8.00000000E-01 0.00000000E+00 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