ALATBASIS=        4.647888936537
BRAVAIS
       0.577350269190        0.577350269190        0.577350269190
       0.577350269190       -0.577350269190       -0.577350269190
      -0.577350269190        0.577350269190       -0.577350269190
NAEZ= 1
CARTESIAN= True

<RBASIS>
       0.000000000000        0.000000000000        0.000000000000

KSHAPE= 2
<SHAPE>
1

NSPIN= 2
<ZATOM>
      26.000000000000

LINIPOL= False
HFIELD=        0.000000000000
LMAX= 3
BZDIVIDE= 10 10 10

EMIN=       -0.500000000000
TEMPR=     1000.000000000000
NPT1= 3
NPT2= 11
NPT3= 3
NPOL= 7
RCLUSTZ=        2.517136094479
INS= 1
RMAX=        7.000000000000
GMAX=       65.000000000000

NSTEPS= 50
IMIX= 5
STRMIX=        0.030000000000
BRYMIX=        0.050000000000
QBOUND= 1.000000e-08

