C 
 1.0000000000000000
     2.5213443334109362    0.0000000000000000    0.0000000000000000
    -1.2606721667054681    2.1835482444218131    0.0000000000000000
     0.0000000000000001    0.0000000000000002   43.2320495787368131
 C  
  42
Selective dynamics
Cartesian
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