31 
polyT cryst-b optimized by PBE-D3paw900, SG=P21/cxz
  S         1.94797536    -0.36576049     0.94567953
  C         0.69052907     0.05975846    -0.18184953
  C         3.20414884     0.06530194    -0.18015953
  C         1.24330068     0.50635372    -1.37595953
  C         2.65069055     0.50951915    -1.37544953
  H         0.64013696     0.83976639    -2.21879953
  H         3.25230706     0.83720392    -2.22116953
  S         5.84100147     0.36576049    -0.94567953
  C         4.58482799    -0.06530194     0.18015953
  C         7.09844777    -0.05975846     0.18184953
  C         5.13828628    -0.50951915     1.37544953
  C         6.54567615    -0.50635372     1.37595953
  H         4.53666977    -0.83720392     2.22116953
  H         7.14883988    -0.83976639     2.21879953
  S         0.47701617     3.16652967     1.99965953
  C        -0.78043012     3.59204862     3.12718858
  C         1.73318965     3.59759210     3.12549858
  C        -0.22765850     4.03864388     4.32129858
  C         1.17973137     4.04180932     4.32078858
  H        -0.83082223     4.37205655     5.16413858
  H         1.78134788     4.36949408     5.16650858
  S         4.37004229     3.89805065     3.89101858
  C         3.11386880     3.46698822     2.76517953
  C         5.62748858     3.47253170     2.76348953
  C         3.66732709     3.02277101     1.56988953
  C         5.07471696     3.02593645     1.56937953
  H         3.06571058     2.69508624     0.72416953
  H         5.67788069     2.69252378     0.72653953
  Tv        7.78897683     0.00000000     0.00000000
  Tv       -2.94191837     7.06458033     0.00000000
  Tv        0.00000000     0.00000000     5.89067811
