number	atom	shift
1	C	131.825
2	C	130.885
3	C	129.499
4	C	131.689
5	C	132.788
6	C	64.510
7	C	68.918
8	C	122.692
9	C	130.485
10	C	78.321
11	C	76.927
12	C	70.185
13	C	70.553
14	C	76.827
15	C	76.373
16	C	74.558
17	C	73.976
18	C	104.492
19	C	98.476
20	C	67.315
21	N	300.586
33	H	8.790
34	H	8.835
35	H	8.755
36	H	9.283
37	H	8.832
38	H	4.921
39	H	5.298
40	H	4.589
41	H	5.915
42	H	4.526
43	H	4.585
44	H	4.326
45	H	4.382
46	H	4.420
47	H	4.232
48	H	4.305
49	H	4.342
50	H	5.056
51	H	4.729
52	H	6.723
53	H	-0.090
54	H	2.189
55	H	2.125
56	H	2.120
57	H	2.137
58	H	1.673
59	H	1.504