REFMAC

TLS
RANGE  'C   2.' 'C 526.' ALL
ORIGIN   102.1239 -41.9369  -9.1007
T     0.9547   0.9808   1.0066   0.0177   0.0012   0.0076
L     0.2406   0.3531   0.6268   0.1534  -0.0138   0.2631
S    -0.0019  -0.0000   0.6151   0.0710   0.0257  -0.6273  -0.0352   0.0027