Solid-state NMR data for publication: Revision of crystal structures with disordered hydrogen Resolving apparent proton disorder in short hydrogen bonds: A combined X-ray diffraction, ssNMR and periodic DFT study

### data from 600 MHz JEOL spectrometer ###DAKWES sample 1H, saturation recovery experiment: /DAKWES/20250203_DEKWES_1.0mm_62.5kHz_satrec_1H_echo-3-1.jdfDAKWES sample 1H, raw 1H-14N 3D RESPDOR data : /DAKWES/20250203_DEKWES_1.0mm_62.5kHz_respdor_3d-1-1.jdfDAKWES sample, extracted S0-part from 1H-14N 3D RESPDOR data : /DAKWES/20250203_DEKWES_1.0mm_62.5kHz_respdor_3d-1-1.jdfDAKWES sample 1H, S-part from 1H-14N 3D RESPDOR data : /DAKWES/20250203_DEKWES_1.0mm_62.5kHz_respdor_3d-1-1.jdf PUHROZ sample 1H, saturation recovery experiment: /PUHROZ/20250312_PUHROZ_1.0mm_62.5kHz_satrec_1H_echo-2-1.jdfPUHROZ sample, raw 1H-14N 3D RESPDOR data : /PUHROZ/20250318_PUHROZ_1.0mm_62.5kHz_respdor_3d-1-1.jdfPUHROZ sample, extracted S0-part from 1H-14N 3D RESPDOR data : /PUHROZ/20250318_PUHROZ_1.0mm_62.5kHz_respdor_3d-1-2.jdfPUHROZ sample, extracted S-part from 1H-14N 3D RESPDOR data : /PUHROZ/20250318_PUHROZ_1.0mm_62.5kHz_respdor_3d-1-3.jdf FAFFAV sample 1H, saturation recovery experiment: /FAFFAV/20250601_FAFFAV_1.0mm_62.5kHz_satrec_1H_echo-1-1.jdfFAFFAV sample, raw 1H-14N 3D RESPDOR data : /FAFFAV/20250601_FAFFAV_1.0mm_62.5kHz_respdor_3d-1-1.jdfFAFFAV sample, extracted S0-part from 1H-14N 3D RESPDOR data : /FAFFAV/20250601_FAFFAV_1.0mm_62.5kHz_respdor_3d-1-2.jdfFAFFAV sample, extracted S-part from 1H-14N 3D RESPDOR data : /FAFFAV/20250601_FAFFAV_1.0mm_62.5kHz_respdor_3d-1-3.jdfFAFFAV sample, raw 1H-14N 3D T-FILTERED RESPDOR data : /FAFFAV/20250609_FAFFAV_1.0mm_62.5kHz_t-filter_RESPDOR_14N_1H-1-1.jdfFAFFAV sample, extracted S0-part from 1H-14N 3D T-FILTERED RESPDOR data : /FAFFAV/20250609_FAFFAV_1.0mm_62.5kHz_t-filter_RESPDOR_14N_1H-1-2.jdfFAFFAV sample, extracted S-part from 1H-14N 3D T-FILTERED RESPDOR data : /FAFFAV/20250609_FAFFAV_1.0mm_62.5kHz_t-filter_RESPDOR_14N_1H-1-3.jdfFAFFAV sample, first reference spectra from T-FILTERED RESPDOR data : /FAFFAV/20250606_FAFFAV_1.0mm_62.5kHz_t-filter_RESPDOR_14N_1H-4-1.jdf JEOL pulse program for T-filtered RESPDOR : jb_t-filter_RESPDOR_SR4_3D.jxp