# Summary of NMR spectra (SCF GIAO Magnetic shielding)
# Values for element C only
# Reference:  TMS B3LYP/6-31G(d,p) Chloroform
# Reference shielding:  192.17 ppm
# Degenerate peaks are condensed together (Degeneracy Tolerance 0.05)
#
#        Shift (ppm)     Degeneracy  Atoms
      214.4654323548         1.0000  17
      149.3796342506         1.0000  6
      116.9159151426         1.0000  10
       91.2733870081         1.0000  28
       64.5492881956         1.0000  13
       60.3287264615         1.0000  16
       54.0142849224         1.0000  9
       52.8535710170         1.0000  3
       47.6330507425         1.0000  41
       46.6313704083         1.0000  18
       44.1901419614         1.0000  40
       40.0650941635         1.0000  30
       33.1802747092         1.0000  27
       32.8728532225         1.0000  11
       31.4585576119         1.0000  2
       30.6847348513         1.0000  23
       27.3620461495         1.0000  1
       26.8669596137         1.0000  50
       22.0544245878         1.0000  31
       21.5648339468         1.0000  46