Supplementary Material to
"NMR Crystallography of the Polymorphs of Metergoline"
by Czernek, Urbanov and Brus (Crystals 2018):
the relevant part of the output file created by 
the POSEL software described in the main text
(in the input file the XRD structure was numbered as #1, 
while the numbering of the CSPs 1--15 went from 2 to 16)
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 FOR THE THRESHOLD SD VALUE FOR ALL PROTONS, OF 1.000
 AND THE THRESHOLD SD VALUE FOR ALL CARBONS, OF 4.000
 THE NUMBER OF CANDIDATES IS   6:

 your structure #   6
 with the covariance, SD(H), and SD(C) values of:
  1.106  0.925  2.370
 you might also consider the SD of 13-C eigenvalues:
   6.0 ppm

 your structure #  10
 with the covariance, SD(H), and SD(C) values of:
  0.967  0.976  2.283
 you might also consider the SD of 13-C eigenvalues:
   5.8 ppm

 your structure #  16
 with the covariance, SD(H), and SD(C) values of:
  0.888  0.987  2.719
 you might also consider the SD of 13-C eigenvalues:
   6.2 ppm

 your structure #  11
 with the covariance, SD(H), and SD(C) values of:
  0.336  0.908  2.026
 you might also consider the SD of 13-C eigenvalues:
   6.6 ppm

 your structure #   7
 with the covariance, SD(H), and SD(C) values of:
  0.226  0.845  2.985
 you might also consider the SD of 13-C eigenvalues:
   5.7 ppm

 your structure #   1
 with the covariance, SD(H), and SD(C) values of:
  0.047  0.226  1.048
 you might also consider the SD of 13-C eigenvalues:
   4.5 ppm
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