3 9 3 8 0.000000 0.000000 0.106808 1 0.000000 0.785017 -0.427232 1 0.000000 -0.785017 -0.427232 Atom Mode X-disp. Y-disp. Z-disp. 1 9 0.000000 -0.070402 0.000000 1 8 0.000000 0.000000 -0.043353 1 7 0.000000 0.000000 -0.071513 2 9 0.000000 0.558805 -0.380150 2 8 0.000000 -0.602321 0.344106 2 7 0.000000 0.365140 0.567625 3 9 0.000000 0.558805 0.380150 3 8 0.000000 0.602321 0.344106 3 7 0.000000 -0.365140 0.567625 3 4148.130 3991.219 1736.568 0.00000E+00 0.72303E-01 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 -0.21661E-17 0.17214E-01 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.16817 0.00000E+00 0.00000E+00 0.00000E+00