UNIT CELL DATA a = 3.5800; b = 3.5800; c = 3.5800 Angstroms alpha = 90.000; beta = 90.000; gamma = 90.000 degrees cell volume = 45.883 A**3 RECIPROCAL UNIT CELL DATA a* = 0.2793; b* = 0.2793; c* = 0.2793 Reciprocal Angstroms alpha* = 90.000; beta* = 90.000; gamma* = 90.000 degrees Lattice type = P Total of: 4 atoms in the unit cell REFLECTIONS LIST X-ray wavelength = 1.5405 A ref no. (N) h k l d(hkl) 2-Theta Intensity I/Imax m(hkl) [ 1] 1 0 1 0 3.58000 24.8491 1.91003e+00 10.2 6 [ 2] 2 1 0 1 2.53144 35.4289 1.53157e+00 8.2 12 [ 3] 3 1 1 1 2.06691 43.7592 1.87592e+01 100.0 8 [ 4] 4 2 0 0 1.79000 50.9741 8.78101e+00 46.8 6 [ 5] 5 2 0 1 1.60102 57.5143 6.78210e-01 3.6 24 [ 6] 6 1 2 1 1.46153 63.6082 4.79097e-01 2.6 24 [ 7] 8 2 2 0 1.26572 74.9689 5.05440e+00 26.9 12 [ 8] 9 0 3 0 1.19333 80.4005 2.77063e-01 1.5 30 [ 9] 10 0 3 1 1.13210 85.7460 1.85763e-01 1.0 24 [ 10] 11 1 3 1 1.07941 91.0545 6.08079e+00 32.4 24 [ 11] 12 2 2 2 1.03346 96.3722 1.83340e+00 9.8 8 [ 12] 13 0 3 2 0.99291 101.7457 1.36312e-01 0.7 24 [ 13] 14 2 1 3 0.95680 107.2265 2.63371e-01 1.4 48 [ 14] 16 0 4 0 0.89500 118.7713 1.26023e+00 6.7 6 [ 15] 17 1 4 0 0.86828 125.0224 2.87817e-01 1.5 48 [ 16] 18 3 3 0 0.84381 131.7959 2.38600e-01 1.3 36 [ 17] 19 1 3 3 0.82131 139.3815 6.73228e+00 35.9 24 [ 18] 20 0 4 2 0.80051 148.3909 8.47450e+00 45.2 24 [ 19] 21 2 4 1 0.78122 160.7738 7.71499e-01 4.1 48