31 
polyT cryst-ay optimized by PBE-D3paw900 at dps-determined cell with xi=1/6, SG=P21/nxz, nm=4
  S         1.94734182    -0.49379768     0.88458146
  C         0.69095113     0.08463768    -0.17183896
  C         3.20283113     0.08247768    -0.17435146
  C         1.24330113     0.67916268    -1.30082396
  C         2.65134613     0.67719018    -1.30377646
  H         0.63673863     1.10536768    -2.09754646
  H         3.25371363     1.10258768    -2.10528146
  S         5.83897408     0.49379768    -0.88458146
  C         4.58348476    -0.08247768     0.17435146
  C         7.09536476    -0.08463768     0.17183896
  C         5.13496976    -0.67719018     1.30377646
  C         6.54301476    -0.67916268     1.30082396
  H         4.53260226    -1.10258768     2.10528146
  H         7.14957726    -1.10536768     2.09754646
  S         3.24353545     4.25734304     3.66657939
  C         1.98804613     3.68106768     2.60764646
  C         4.49992613     3.67890768     2.61015896
  C         2.53953113     3.08635518     1.47822146
  C         3.94757613     3.08438268     1.48117396
  H         1.93716363     2.66095768     0.67671646
  H         4.55413863     2.65817768     0.68445146
  S         7.13821908     3.26974768     1.89741646
  C         5.88182839     3.84818304     2.95383689
  C         8.39370839     3.84602304     2.95634939
  C         6.43417839     4.44270804     4.08282189
  C         7.84222339     4.44073554     4.08577439
  H         5.82761589     4.86891304     4.87954439
  H         8.44459089     4.86613304     4.88727939
  Tv        7.78631589     0.00000000     0.00000000
  Tv        2.59543863     7.52709072     0.00000000
  Tv        0.00000000     0.00000000     5.56399585
