27
XYZ file for : ots1 in P 21/n
  O        2.89736        0.89105       -2.28407
  O        0.63962        1.25775       -1.47252
  F        2.48620        3.53367       -1.06098
  S        2.00647        0.96323       -1.16049
  H       -4.00010       -3.88158       -0.42336
  H       -0.86897       -3.50198       -0.46324
  C        2.56071        2.45821       -0.28060
  O        2.18704       -0.07962       -0.18139
  C       -1.29511       -2.78456       -0.05259
  F        3.82416        2.34794        0.11724
  H        0.06447       -1.29641       -0.09766
  H       -2.99774       -4.73800        0.42477
  C       -3.50148       -3.92136        0.39602
  C       -0.78650       -1.58226        0.14562
  N       -2.58568       -2.78013        0.46627
  F        1.82214        2.68447        0.79747
  H       -4.81131       -1.25650        1.01958
  H       -4.10668       -3.89229        1.14062
  H       -0.83966        0.95113        0.71856
  N       -1.76102       -0.82193        0.78667
  C       -2.83445       -1.57902        0.96441
  H       -2.38014        1.06878        0.98461
  C       -1.58466        0.57264        1.19114
  C       -4.07480       -1.16007        1.62781
  H       -3.99964       -0.24150        1.89625
  H       -4.22496       -1.70825        2.40144
  H       -1.41839        0.61323        2.13572
