P   LATTICE,NONEQUIV.ATOMS   9   92 P41212                                     
MODE OF CALC=RELA unit=bohr                                                    
 13.555006 13.555006 49.690349 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.15191000 Y=0.12289000 Z=0.43089000
          MULT= 8          ISPLIT= 8
      -1: X=0.37711000 Y=0.65191000 Z=0.68089000
      -1: X=0.65191000 Y=0.37711000 Z=0.31911000
      -1: X=0.84809000 Y=0.87711000 Z=0.93089000
      -1: X=0.12289000 Y=0.15191000 Z=0.56911000
      -1: X=0.62289000 Y=0.34809000 Z=0.18089000
      -1: X=0.34809000 Y=0.62289000 Z=0.81911000
      -1: X=0.87711000 Y=0.84809000 Z=0.06911000
Ca         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  20.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.12776000 Y=0.34635000 Z=0.18516000
          MULT= 8          ISPLIT= 8
      -2: X=0.15365000 Y=0.62776000 Z=0.43516000
      -2: X=0.62776000 Y=0.15365000 Z=0.56484000
      -2: X=0.87224000 Y=0.65365000 Z=0.68516000
      -2: X=0.34635000 Y=0.12776000 Z=0.81484000
      -2: X=0.84635000 Y=0.37224000 Z=0.93516000
      -2: X=0.37224000 Y=0.84635000 Z=0.06484000
      -2: X=0.65365000 Y=0.87224000 Z=0.31484000
Ca         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  20.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.38660000 Y=0.13250000 Z=0.25774000
          MULT= 8          ISPLIT= 8
      -3: X=0.36750000 Y=0.88660000 Z=0.50774000
      -3: X=0.88660000 Y=0.36750000 Z=0.49226000
      -3: X=0.61340000 Y=0.86750000 Z=0.75774000
      -3: X=0.13250000 Y=0.38660000 Z=0.74226000
      -3: X=0.63250000 Y=0.11340000 Z=0.00774000
      -3: X=0.11340000 Y=0.63250000 Z=0.99226000
      -3: X=0.86750000 Y=0.61340000 Z=0.24226000
P          NPT=  781  R0=.000100000 RMT= 2.14        Z:  15.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.63530000 Y=0.63530000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -4: X=0.86470000 Y=0.13530000 Z=0.25000000
      -4: X=0.13530000 Y=0.86470000 Z=0.75000000
      -4: X=0.36470000 Y=0.36470000 Z=0.50000000
P          NPT=  781  R0=.000100000 RMT= 2.14        Z:  15.00000              
LOCAL ROT MATRIX:    0.0000000 0.7071068 0.7071068
                     0.0000000-0.7071068 0.7071068
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.07523000 Y=0.38160000 Z=0.34714000
          MULT= 8          ISPLIT= 8
      -5: X=0.11840000 Y=0.57523000 Z=0.59714000
      -5: X=0.57523000 Y=0.11840000 Z=0.40286000
      -5: X=0.92477000 Y=0.61840000 Z=0.84714000
      -5: X=0.38160000 Y=0.07523000 Z=0.65286000
      -5: X=0.88160000 Y=0.42477000 Z=0.09714000
      -5: X=0.42477000 Y=0.88160000 Z=0.90286000
      -5: X=0.61840000 Y=0.92477000 Z=0.15286000
P          NPT=  781  R0=.000100000 RMT= 2.14        Z:  15.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.11610000 Y=0.11610000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -6: X=0.38390000 Y=0.61610000 Z=0.25000000
      -6: X=0.61610000 Y=0.38390000 Z=0.75000000
      -6: X=0.88390000 Y=0.88390000 Z=0.50000000
P          NPT=  781  R0=.000100000 RMT= 2.14        Z:  15.00000              
LOCAL ROT MATRIX:    0.0000000 0.7071068 0.7071068
                     0.0000000-0.7071068 0.7071068
                     1.0000000 0.0000000 0.0000000
ATOM  -7: X=0.36900000 Y=0.43091000 Z=0.09803000
          MULT= 8          ISPLIT= 8
      -7: X=0.06909000 Y=0.86900000 Z=0.34803000
      -7: X=0.86900000 Y=0.06909000 Z=0.65197000
      -7: X=0.63100000 Y=0.56909000 Z=0.59803000
      -7: X=0.43091000 Y=0.36900000 Z=0.90197000
      -7: X=0.93091000 Y=0.13100000 Z=0.84803000
      -7: X=0.13100000 Y=0.93091000 Z=0.15197000
      -7: X=0.56909000 Y=0.63100000 Z=0.40197000
P          NPT=  781  R0=.000100000 RMT= 2.14        Z:  15.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -8: X=0.12646000 Y=0.38430000 Z=0.04437000
          MULT= 8          ISPLIT= 8
      -8: X=0.11570000 Y=0.62646000 Z=0.29437000
      -8: X=0.62646000 Y=0.11570000 Z=0.70563000
      -8: X=0.87354000 Y=0.61570000 Z=0.54437000
      -8: X=0.38430000 Y=0.12646000 Z=0.95563000
      -8: X=0.88430000 Y=0.37354000 Z=0.79437000
      -8: X=0.37354000 Y=0.88430000 Z=0.20563000
      -8: X=0.61570000 Y=0.87354000 Z=0.45563000
Si         NPT=  781  R0=.000100000 RMT= 2.04        Z:  14.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -9: X=0.11640000 Y=0.12367000 Z=0.29955000
          MULT= 8          ISPLIT= 8
      -9: X=0.37633000 Y=0.61640000 Z=0.54955000
      -9: X=0.61640000 Y=0.37633000 Z=0.45045000
      -9: X=0.88360000 Y=0.87633000 Z=0.79955000
      -9: X=0.12367000 Y=0.11640000 Z=0.70045000
      -9: X=0.62367000 Y=0.38360000 Z=0.04955000
      -9: X=0.38360000 Y=0.62367000 Z=0.95045000
      -9: X=0.87633000 Y=0.88360000 Z=0.20045000
Si         NPT=  781  R0=.000100000 RMT= 2.04        Z:  14.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000