unit cell 156.884 156.884 156.884 90.000 90.000 90.000 crystal rotx -61.048 roty 127.459 rotz -21.443 cassette rotx -0.23 roty 0.06 rotz 0.00 distance 170.00 x beam 89.669 y beam 89.850 film rotation 0.000 radial offset -0.185 angular offset -0.064 crossfire y -0.009 x 0.054 xy -0.017