number	atom	shift
1	C	84.602
2	C	70.920
4	C	71.898
6	C	76.750
7	C	100.444
8	C	71.129
10	C	98.033
13	C	76.594
16	C	104.666
17	C	81.651
18	C	76.660
20	C	68.988
22	C	75.446
23	C	68.055
24	C	61.936
26	C	72.449
27	C	76.728
28	C	74.163
29	C	71.919
34	C	59.616
35	C	74.882
37	C	72.014
38	C	66.498
40	C	96.203
46	H	4.540
47	H	6.113
48	H	5.324
49	H	4.802
50	H	5.092
51	H	5.559
52	H	4.033
53	H	2.234
54	H	6.844
55	H	5.297
56	H	1.114
57	H	5.696
58	H	5.029
59	H	4.791
60	H	1.423
61	H	5.353
62	H	3.896
63	H	4.034
64	H	4.734
65	H	4.373
66	H	2.335
67	H	4.608
68	H	4.776
69	H	5.673
70	H	4.999
71	H	1.842
72	H	1.023
73	H	4.537
74	H	4.679
75	H	5.611
76	H	3.835
77	H	0.189
78	H	3.444
79	H	4.756
80	H	5.506
81	H	1.186
82	H	6.088
83	H	4.423
84	H	1.177
85	H	4.293
86	H	0.364
87	H	1.203