Label	Index	Isotropic / ppm	Anisotropy / ppm	Asymmetry
H5O	1		-13.01	-20.19	0.2032
H7O	2		-20.09	-20.63	0.2444
H9O	3		-18.44	-15.68	0.3263
H2N	4		-19.82	-18.1	0.239
H3N	5		-18.97	-9.519	0.3647
1H01	6		-28.46	4.436	0.4393
2H01	7		-26.63	-5.453	0.4062
H21	8		-26.62	-6.264	0.3394
H22	9		-27.52	-3.875	0.9009
H31	10		-27.31	-5.536	0.403
H32	11		-27.2	-4.296	0.2024
H41	12		-28.1	6.161	0.868
H42	13		-26.54	4.274	0.9099
H51	14		-28.4	-5.44	0.5742
H51	15		-27.38	-5.635	0.8183
H52	16		-27.86	-5.368	0.6553
H7	17		-22.12	-4.65	0.2303
H10	18		-24.94	1.037	0.4082
H11	19		-23.91	-3.088	0.5815
1H12	20		-26.88	-4.321	0.5504
2H12	21		-26.09	-5.58	0.9608
1H13	22		-28.93	-6.601	0.3407
2H13	23		-29.47	-5.645	0.1683
3H13	24		-28.53	-6.09	0.6178
1H18	25		-27.52	-5.025	0.4832
2H18	26		-25.43	7.367	0.9406
3H18	27		-26.87	-4.527	0.8905
1H20	28		-28.11	2.88	0.9516
2H20	29		-28.36	-4.616	0.5095
1H21	30		-29.36	5.313	0.9033
2H21	31		-29.73	-3.435	0.8526
1H22	32		-29.16	-6.482	0.5403
2H22	33		-29.72	-5.323	0.3545
3H22	34		-29.99	-4.351	0.2876
1H24	35		-28.55	-4.398	0.4787
2H24	36		-28.01	-3.651	0.6303
1H26	37		-27.92	-4.055	0.8711
2H26	38		-28.97	-2.603	0.9759
C1	1		-127.1	-25.57	0.4387
C2	2		-119.7	-30.44	0.3798
C3	3		-120.4	-27.36	0.5812
C4	4		-126.3	-28.61	0.2536
C5	5		-127.9	-43.88	0.1318
C6	6		-43.89	-85.44	0.7757
C7	7		-38.27	-125.6	0.5237
C8	8		-51.07	-99.81	0.372
C9	9		-9	-88.61	0.5285
C10	10		-58.66	-110.4	0.5826
C11	11		-39.44	-124.5	0.5977
C12	12		-102.4	-48.49	0.1437
C13	13		-157.8	12.94	0.9596
C14	14		-20.29	77.93	0.9871
C15	15		-20.66	88.84	0.5023
C16	16		-45.88	-89.9	0.02657
C17	17		-33.34	-83.82	0.2411
C18	18		-135.1	-41.57	0.1487
C19	19		-21.32	-96.01	0.3373
C20	20		-143.8	20.94	0.9569
C21	21		-141.5	-12.19	0.5502
C22	22		-156.8	-18.42	0.2427
C23	23		2.976	88.66	0.6469
C24	24		-126.7	-15.05	0.9233
C25	25		-91.83	-28.39	0.1761
C26	26		-125.6	-22.31	0.6287
C27	27		-1.167	92.98	0.396
C28	28		8.397	-72.72	0.815
