          44
 
   N          2.01718688      1.27404428      0.02015542
   C          1.54748742      0.06995568      0.39774341
   C          0.25468103     -0.08627093      0.91076075
   C         -0.67974903      0.97970250      0.98418982
   C         -2.13504799      0.62002356      1.47254483
   O         -0.48089546      2.16889637      0.67461361
   C         -3.11323264      0.39902914      0.25152938
   C         -4.53696417     -0.21026384      0.60524393
   C         -5.57185591      0.02164426     -0.53760083
   C         -6.96806553     -0.62470157     -0.30489684
   C          2.42591039     -1.12548114      0.30545965
   C          3.73370288     -1.09981741      0.82165371
   C          4.53531511     -2.24117363      0.77119400
   C          4.04376256     -3.41942807      0.19722583
   C          2.74374005     -3.45272290     -0.31838090
   C          1.93612127     -2.31453326     -0.26009616
   H          4.10779304     -0.18759722      1.27998768
   H          5.54099486     -2.21377586      1.18574044
   H          4.67007092     -4.30821348      0.15599119
   H          2.35717393     -4.36582375     -0.76617810
   H          0.92511572     -2.33423331     -0.66037971
   C          3.16671681      1.56983823     -0.84792983
   C          2.65565166      2.17032907     -2.16682517
   C          4.13458854      2.52010537     -0.13101546
   H          3.67562540      0.62584955     -1.06024829
   H          4.98805816      2.74973038     -0.78129880
   H          3.62837234      3.46203862      0.11885783
   H          4.50841123      2.07244910      0.79749893
   H          3.50124634      2.39768959     -2.82823596
   H          1.98361587      1.47033784     -2.67714557
   H          2.10731098      3.10233833     -1.97462152
   H          1.33575284      2.03167067      0.14713666
   H         -0.03092899     -1.07032632      1.25835855
   F         -2.15150235     -0.53156475      2.22537859
   F         -2.61316762      1.63085350      2.24713591
   F         -3.31492614      1.60181669     -0.36280910
   F         -2.49986736     -0.43937704     -0.63210493
   F         -5.01026650      0.41121881      1.72495915
   F         -4.39566293     -1.53541063      0.87088477
   H         -5.72753216      1.10173330     -0.63595778
   F         -5.07136287     -0.47915772     -1.72373716
   F         -7.77599696     -0.28053512     -1.33916100
   F         -6.91639087     -1.96805875     -0.24849473
   F         -7.53099073     -0.16282816      0.83287379
