Reading the GBW file orca_nmr.gbw              ... ... done.
Reading the input file orca.nmrspec           ... ... done.
--------------------------------------------------------------------------- 
NMR Spectrum simulated based on computed shieldings and coupling constants  
--------------------------------------------------------------------------- 

 NMR Shielding File: orca_nmr.property.txt 
 NMR Couplings File: orca_sscc.property.txt 
 Simulated spectrometer frequency :      80.00 MHz 
 Corresponding spectrometer fieldstrength :       1.88 Tesla 
 User-defined shielding reference value for nuclei of type 1 :    31.110000 ppm 
 User-defined shielding reference value for nuclei of type 6 :   179.730000 ppm 
 Lines coalesce below   1.0000 Hz difference 
 Printlevel : 0  NAtoms 15 

Atom 0, diagonalizing spin Hamiltonian of size 6 ... ... done.
Atom 1, diagonalizing spin Hamiltonian of size 2 ... ... done.
Atom 2, diagonalizing spin Hamiltonian of size 2 ... ... done.
Atom 3, diagonalizing spin Hamiltonian of size 2 ... ... done.
Atom 4, diagonalizing spin Hamiltonian of size 2 ... ... done.
Atom 5, diagonalizing spin Hamiltonian of size 2 ... ... done.
Atom 6, diagonalizing spin Hamiltonian of size 2 ... ... done.
Atom 7, diagonalizing spin Hamiltonian of size 6 ... ... done.
Atom 8, diagonalizing spin Hamiltonian of size 2 ... ... done.
Atom 9, diagonalizing spin Hamiltonian of size 2 ... ... done.
Atom 10, diagonalizing spin Hamiltonian of size 16 ... ... done.
Atom 11, diagonalizing spin Hamiltonian of size 8 ... ... done.
Atom 12, diagonalizing spin Hamiltonian of size 16 ... ... done.
Atom 13, diagonalizing spin Hamiltonian of size 2 ... ... done.
Atom 14, diagonalizing spin Hamiltonian of size 8 ... ... done.

----------------------------------------------------- 
 NMR Peaks for atom type 1, ref value  31.1100 ppm : 
----------------------------------------------------- 
Atom   shift[ppm]   rel.intensity  
   9        4.39    1.00 
  10        6.68    1.00 
  10        6.57    1.00 
  10        6.66    1.00 
  10        6.56    1.00 
  10        6.64    1.00 
  10        6.53    1.00 
  10        6.62    1.00 
  10        6.52    1.00 
  11        7.32    1.00 
  11        7.22    2.00 
  11        7.12    2.00 
  12        7.80    1.00 
  12        7.78    2.00 
  12        7.69    1.00 
  12        7.68    2.00 
  12        7.76    1.00 
  12        7.66    1.00 
  13       10.06    1.00 
  14        7.16    1.00 
  14        7.14    1.00 
  14        7.10    1.00 

----------------------------------------------------- 
 NMR Peaks for atom type 6, ref value 179.7300 ppm : 
----------------------------------------------------- 
Atom   shift[ppm]   rel.intensity  
   1      164.39    1.00 
   2      122.95    1.00 
   3      133.96    1.00 
   4      123.33    1.00 
   5      143.41    1.00 
   6      195.16    1.00 
   8      124.61    1.00 

----------------------------------------------------- 
 NMR Peaks for atom type 8, ref value 193.0962 ppm : 
----------------------------------------------------- 
Atom   shift[ppm]   rel.intensity  
   0        0.00    5.00 
   7      498.95    5.00 

----------------------------------------------------- 
Total time                               ...      0.008 sec (=   0.000 min)
Time in spin Hamiltonian diagonalization ...      0.000 sec (=   0.000 min)
------------------------------------------------------------------------------

