P LATTICE,NONEQUIV.ATOMS 4 62 Pnma MODE OF CALC=RELA unit=bohr 43.558187 8.258103 8.428179 90.000000 90.000000 90.000000 ATOM -1: X=0.11560000 Y=0.25000000 Z=0.72510000 MULT= 4 ISPLIT= 8 -1: X=0.88440000 Y=0.75000000 Z=0.27490000 -1: X=0.61560000 Y=0.25000000 Z=0.77490000 -1: X=0.38440000 Y=0.75000000 Z=0.22510000 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=0.25010000 Y=0.25000000 Z=0.22470000 MULT= 4 ISPLIT= 8 -2: X=0.74990000 Y=0.75000000 Z=0.77530000 -2: X=0.75010000 Y=0.25000000 Z=0.27530000 -2: X=0.24990000 Y=0.75000000 Z=0.72470000 Zn NPT= 781 R0=.000050000 RMT= 2.50000 Z: 30.00000 LOCAL ROT MATRIX: 0.0000000 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 1.0000000 0.0000000 0.0000000 ATOM -3: X=0.00100000 Y=0.25000000 Z=0.21900000 MULT= 4 ISPLIT= 8 -3: X=0.99900000 Y=0.75000000 Z=0.78100000 -3: X=0.50100000 Y=0.25000000 Z=0.28100000 -3: X=0.49900000 Y=0.75000000 Z=0.71900000 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 -4: X=0.32290000 Y=0.25000000 Z=0.72500000 MULT= 4 ISPLIT= 8 -4: X=0.67710000 Y=0.75000000 Z=0.27500000 -4: X=0.82290000 Y=0.25000000 Z=0.77500000 -4: X=0.17710000 Y=0.75000000 Z=0.22500000 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