B LATTICE,NONEQUIV.ATOMS 2 74 Imma MODE OF CALC=RELA unit=bohr 7.908504 12.944624 15.200957 90.000000 90.000000 90.000000 ATOM -1: X=0.00000000 Y=0.05100000 Z=0.16100000 MULT= 4 ISPLIT=15 -1: X=0.00000000 Y=0.94900000 Z=0.83900000 -1: X=0.00000000 Y=0.55100000 Z=0.83900000 -1: X=0.00000000 Y=0.44900000 Z=0.16100000 Ga NPT= 781 R0=.000050000 RMT= 2.00000 Z: 31.00000 LOCAL ROT MATRIX: 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 ATOM -2: X=0.00000000 Y=0.25000000 Z=0.56200000 MULT= 2 ISPLIT=15 -2: X=0.00000000 Y=0.75000000 Z=0.43800000 Lu NPT= 781 R0=.000010000 RMT= 2.00000 Z: 71.00000 LOCAL ROT MATRIX: 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000 0.0000000 0.0000000 0.0000000 1.0000000