P LATTICE,NONEQUIV.ATOMS 5 11 P21/m MODE OF CALC=RELA unit=bohr 20.180385 9.233202 9.029111 90.000000 90.000000 91.800000 ATOM -1: X=0.76370000 Y=0.25810000 Z=0.25000000 MULT= 2 ISPLIT= 8 -1: X=0.23630000 Y=0.74190000 Z=0.75000000 Sr NPT= 781 R0=.000010000 RMT= 2.50000 Z: 38.00000 LOCAL ROT MATRIX: 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 ATOM -2: X=0.00280000 Y=0.69480000 Z=0.25000000 MULT= 2 ISPLIT= 8 -2: X=0.99720000 Y=0.30520000 Z=0.75000000 Pd NPT= 781 R0=.000010000 RMT= 2.43 Z: 46.00000 LOCAL ROT MATRIX: 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 ATOM -3: X=0.36620000 Y=0.24180000 Z=0.25000000 MULT= 2 ISPLIT= 8 -3: X=0.63380000 Y=0.75820000 Z=0.75000000 Pd NPT= 781 R0=.000010000 RMT= 2.43 Z: 46.00000 LOCAL ROT MATRIX: 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 ATOM -4: X=0.49990000 Y=0.74880000 Z=0.25000000 MULT= 2 ISPLIT= 8 -4: X=0.50010000 Y=0.25120000 Z=0.75000000 Bi NPT= 781 R0=.000005000 RMT= 2.50000 Z: 83.00000 LOCAL ROT MATRIX: 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 ATOM -5: X=0.11750000 Y=0.21000000 Z=0.25000000 MULT= 2 ISPLIT= 8 -5: X=0.88250000 Y=0.79000000 Z=0.75000000 Bi NPT= 781 R0=.000005000 RMT= 2.50000 Z: 83.00000 LOCAL ROT MATRIX: 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000