REFMAC

TLS
RANGE  'E   2.' 'E 526.' ALL
ORIGIN    36.7347  -8.7595  -7.4807
T     0.8294   0.8066   0.8648  -0.0309   0.0069  -0.0026
L     0.5034   0.3925   0.6849  -0.2354   0.2269  -0.0385
S    -0.0120   0.0060   0.5945  -0.0019  -0.1033  -0.5844   0.0262   0.0960