P LATTICE,NONEQUIV.ATOMS 8 62 Pnma MODE OF CALC=RELA unit=bohr 19.010645 8.241852 43.338979 90.000000 90.000000 90.000000 ATOM -1: X=0.06080000 Y=0.25000000 Z=0.13005000 MULT= 4 ISPLIT= 8 -1: X=0.93920000 Y=0.75000000 Z=0.86995000 -1: X=0.56080000 Y=0.25000000 Z=0.36995000 -1: X=0.43920000 Y=0.75000000 Z=0.63005000 Sr NPT= 781 R0=.000010000 RMT= 2.50000 Z: 38.00000 LOCAL ROT MATRIX: 0.0000000 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 1.0000000 0.0000000 0.0000000 ATOM -2: X=0.27652000 Y=0.25000000 Z=0.25023000 MULT= 4 ISPLIT= 8 -2: X=0.72348000 Y=0.75000000 Z=0.74977000 -2: X=0.77652000 Y=0.25000000 Z=0.24977000 -2: X=0.22348000 Y=0.75000000 Z=0.75023000 Sn NPT= 781 R0=.000010000 RMT= 2.50000 Z: 50.00000 LOCAL ROT MATRIX: 0.0000000 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 1.0000000 0.0000000 0.0000000 ATOM -3: X=0.34950000 Y=0.25000000 Z=0.01011000 MULT= 4 ISPLIT= 8 -3: X=0.65050000 Y=0.75000000 Z=0.98989000 -3: X=0.84950000 Y=0.25000000 Z=0.48989000 -3: X=0.15050000 Y=0.75000000 Z=0.51011000 Sn NPT= 781 R0=.000010000 RMT= 2.50000 Z: 50.00000 LOCAL ROT MATRIX: 0.0000000 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 1.0000000 0.0000000 0.0000000 ATOM -4: X=0.45758000 Y=0.25000000 Z=0.85027000 MULT= 4 ISPLIT= 8 -4: X=0.54242000 Y=0.75000000 Z=0.14973000 -4: X=0.95758000 Y=0.25000000 Z=0.64973000 -4: X=0.04242000 Y=0.75000000 Z=0.35027000 Sn NPT= 781 R0=.000010000 RMT= 2.50000 Z: 50.00000 LOCAL ROT MATRIX: 0.0000000 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 1.0000000 0.0000000 0.0000000 ATOM -5: X=0.03441000 Y=0.25000000 Z=0.76722000 MULT= 4 ISPLIT= 8 -5: X=0.96559000 Y=0.75000000 Z=0.23278000 -5: X=0.53441000 Y=0.25000000 Z=0.73278000 -5: X=0.46559000 Y=0.75000000 Z=0.26722000 Sb NPT= 781 R0=.000010000 RMT= 2.50000 Z: 51.00000 LOCAL ROT MATRIX: 0.0000000 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 1.0000000 0.0000000 0.0000000 ATOM -6: X=0.20173000 Y=0.25000000 Z=0.59224000 MULT= 4 ISPLIT= 8 -6: X=0.79827000 Y=0.75000000 Z=0.40776000 -6: X=0.70173000 Y=0.25000000 Z=0.90776000 -6: X=0.29827000 Y=0.75000000 Z=0.09224000 Sb NPT= 781 R0=.000010000 RMT= 2.50000 Z: 51.00000 LOCAL ROT MATRIX: 0.0000000 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 1.0000000 0.0000000 0.0000000 ATOM -7: X=0.21092000 Y=0.25000000 Z=0.37534000 MULT= 4 ISPLIT= 8 -7: X=0.78908000 Y=0.75000000 Z=0.62466000 -7: X=0.71092000 Y=0.25000000 Z=0.12466000 -7: X=0.28908000 Y=0.75000000 Z=0.87534000 Sb NPT= 781 R0=.000010000 RMT= 2.50000 Z: 51.00000 LOCAL ROT MATRIX: 0.0000000 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 1.0000000 0.0000000 0.0000000 ATOM -8: X=0.57006000 Y=0.25000000 Z=0.52914000 MULT= 4 ISPLIT= 8 -8: X=0.42994000 Y=0.75000000 Z=0.47086000 -8: X=0.07006000 Y=0.25000000 Z=0.97086000 -8: X=0.92994000 Y=0.75000000 Z=0.02914000 Sb NPT= 781 R0=.000010000 RMT= 2.50000 Z: 51.00000 LOCAL ROT MATRIX: 0.0000000 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 1.0000000 0.0000000 0.0000000