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# SCF GIAO Magnetic shielding

# X-Axis: Shift (ppm)


# Y-Axis: Degeneracy
# Reference: TMS HF/6-31G(d) GIAO
# Reference shielding: 199.985 ppm
# NMR Degeneracy Tolerance: 0.05
#
#
X
Y
15-C
182.6116554125
1.0000000000
23-C
148.8348848627
1.0000000000
11-C
147.6954488848
1.0000000000
1-C
146.5783541753
1.0000000000
16-C
139.5694319524
1.0000000000
5-C
138.7108492158
1.0000000000
4-C
138.0630386132
1.0000000000
18-C
136.5330860674
1.0000000000
6-C
134.1592468895
1.0000000000
21-C
134.1399597230
2.0000000000
2-C
133.2945436996
1.0000000000
17-C
133.1422774614
1.0000000000
19-C
132.0398639460
1.0000000000
3-C
129.8727613104
1.0000000000
13-C
120.1534261821
1.0000000000

Degeneracy
1.0000000000
1.0000000000
1.0000000000
1.0000000000
1.0000000000
1.0000000000
1.0000000000
1.0000000000
2.0000000000
2.0000000000
1.0000000000
1.0000000000
1.0000000000
1.0000000000
1.0000000000

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