REFMAC

TLS
RANGE  'M   2.' 'M 526.' ALL
ORIGIN   100.2475  44.5550  61.1716
T     1.0105   1.0347   1.0650  -0.0155   0.0071   0.0113
L     0.3049   0.4079   0.6698  -0.1121   0.1158   0.3158
S     0.0101  -0.0051  -0.6653  -0.0443  -0.0105   0.6740   0.0191   0.0004