# Summary of NMR spectra ( SCF GIAO Magnetic shielding)
# Values for element H only
# Reference:  TMS mPW1PW91/6-31G(d,p) CDCl3 GIAO
# Reference shielding:  31.7324 ppm
# Degenerate peaks are condensed together (Degeneracy Tolerance 0.05)
#
#        Shift (ppm)     Degeneracy  Atoms
        7.7067000000         1.0000  38
        7.4259000000         1.0000  27
        6.8690000000         1.0000  29
        6.7324000000         1.0000  32
        6.5886000000         1.0000  28
        6.0543000000         2.0000  39,40
        4.1195000000         2.0000  35,41
        4.0380000000         1.0000  47
        3.8240500000         2.0000  44,30
        3.7458500000         2.0000  36,34
        3.6342571429         7.0000  48,37,49,42,43,45,46
        3.0525000000         1.0000  31
        3.0000000000         1.0000  33