 Tb S O
   1.0
     8.1901247799999997    0.0000000000000000   -0.0151050700000000
     0.0000000000000000    6.8680251500000002    0.0000000000000000
    -1.1202273300000001    0.0000000000000000    6.7234564900000002
 Tb S O
   8   8   4
Direct
   0.9230598600000000  0.6419411900000001  0.1806699500000000
   0.0769401400000000  0.1419411900000000  0.3193300500000000
   0.0769401400000000  0.3580588100000000  0.8193300500000000
   0.9230598600000000  0.8580588099999999  0.6806699500000000
   0.3632005500000000  0.5542965300000000  0.2499374000000000
   0.6367994500000000  0.0542965300000000  0.2500626000000000
   0.6367994500000000  0.4457034700000000  0.7500626000000000
   0.3632005500000000  0.9457034700000000  0.7499374000000000
   0.4227440000000000  0.2778011600000000  0.9705073700000000
   0.5772560000000000  0.7778011600000000  0.5294926300000000
   0.5772560000000000  0.7221988400000000  0.0294926300000000
   0.4227440000000000  0.2221988400000000  0.4705073700000000
   0.8194902400000000  0.1354195900000000  0.9279249000000001
   0.1805097600000000  0.6354195899999999  0.5720750999999999
   0.1805097600000000  0.8645804100000000  0.0720751000000000
   0.8194902400000000  0.3645804100000000  0.4279249000000000
   0.1169750000000000  0.0872853600000000  0.6496315699999999
   0.8830249999999999  0.5872853600000000  0.8503684300000001
   0.8830249999999999  0.9127146400000000  0.3503684300000000
   0.1169750000000000  0.4127146400000000  0.1496315700000000