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Sample TextSymmetry turned off by external request.
Stoichiometry    C20H17N5
Framework group  C1[X(C20H17N5)]
Deg. of freedom   120
Full point group                 C1      NOp   1
Rotational constants (GHZ):      1.1753705      0.0577117      0.0565447
open of exec.fil failed.

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