download nmr filepath = NMR_spectra/JBW-29Si-Asselman-2022-JBW_hydrated-spec.txt

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"29Si MAS NMR spectrum of hydrated JBW" ##freq 1.00018 ##ppm spectr model Q4(4Al) Q4(4Al) ----- -79.1000 0.0028 0.0028 0.0021 0.0008 -79.2000 0.0034 0.0029 0.0022 0.0008 -79.3000 0.0051 0.0030 0.0022 0.0008 -79.4000 0.0078 0.0032 0.0023 0.0008 -79.5000 0.0116 0.0033 0.0024 0.0008 -79.6000 0.0154 0.0034 0.0025 0.0009 -79.7000 0.0169 0.0036 0.0027 0.0009 -79.8000 0.0169 0.0037 0.0028 0.0009 -79.9000 0.0154 0.0039 0.0029 0.0009 -80.0000 0.0119 0.0040 0.0031 0.0010 -80.1000 0.0080 0.0042 0.0032 0.0010 -80.2000 0.0056 0.0044 0.0034 0.0010 -80.3000 0.0036 0.0046 0.0036 0.0011 -80.4000 0.0043 0.0048 0.0038 0.0011 -80.5000 0.0053 0.0051 0.0040 0.0011 -80.6000 0.0061 0.0053 0.0042 0.0012 -80.7000 0.0074 0.0056 0.0044 0.0012 -80.8000 0.0089 0.0059 0.0047 0.0012 -80.9000 0.0112 0.0063 0.0050 0.0013 -81.0000 0.0143 0.0066 0.0053 0.0013 -81.1000 0.0154 0.0070 0.0057 0.0014 -81.2000 0.0143 0.0074 0.0060 0.0014 -81.3000 0.0127 0.0079 0.0065 0.0014 -81.4000 0.0112 0.0084 0.0069 0.0015 -81.5000 0.0075 0.0090 0.0075 0.0015 -81.6000 -0.0012 0.0097 0.0081 0.0016 -81.7000 -0.0091 0.0104 0.0087 0.0017 -81.8000 -0.0101 0.0112 0.0095 0.0017 -81.9000 -0.0085 0.0122 0.0104 0.0018 -82.0000 -0.0070 0.0133 0.0115 0.0019 -82.1000 0.0025 0.0148 0.0128 0.0019 -82.2000 0.0035 0.0166 0.0146 0.0020 -82.3000 0.0133 0.0191 0.0170 0.0021 -82.4000 0.0266 0.0227 0.0205 0.0022 -82.5000 0.0331 0.0278 0.0256 0.0023 -82.6000 0.0406 0.0354 0.0330 0.0024 -82.7000 0.0498 0.0465 0.0440 0.0025 -82.8000 0.0637 0.0623 0.0597 0.0026 -82.9000 0.0808 0.0847 0.0819 0.0027 -83.0000 0.1039 0.1151 0.1123 0.0029 -83.1000 0.1346 0.1552 0.1522 0.0030 -83.2000 0.1859 0.2059 0.2028 0.0032 -83.3000 0.2443 0.2676 0.2642 0.0033 -83.4000 0.3380 0.3391 0.3355 0.0035 -83.5000 0.4340 0.4179 0.4142 0.0037 -83.6000 0.5165 0.4999 0.4960 0.0039 -83.7000 0.5999 0.5796 0.5754 0.0042 -83.8000 0.6565 0.6499 0.6454 0.0045 -83.9000 0.7029 0.7035 0.6986 0.0049 -84.0000 0.7248 0.7335 0.7281 0.0054 -84.1000 0.7299 0.7358 0.7298 0.0060 -84.2000 0.7098 0.7100 0.7032 0.0068 -84.3000 0.6576 0.6603 0.6523 0.0080 -84.4000 0.5889 0.5934 0.5838 0.0096 -84.5000 0.5117 0.5168 0.5051 0.0117 -84.6000 0.4360 0.4380 0.4233 0.0147 -84.7000 0.3470 0.3629 0.3440 0.0189 -84.8000 0.2980 0.2963 0.2718 0.0246 -84.9000 0.2501 0.2414 0.2091 0.0322 -85.0000 0.2169 0.1998 0.1573 0.0425 -85.1000 0.1878 0.1722 0.1162 0.0560 -85.2000 0.1647 0.1583 0.0849 0.0734 -85.3000 0.1643 0.1574 0.0619 0.0955 -85.4000 0.1783 0.1686 0.0455 0.1231 -85.5000 0.2022 0.1910 0.0341 0.1569 -85.6000 0.2359 0.2238 0.0263 0.1975 -85.7000 0.2751 0.2662 0.0210 0.2453 -85.8000 0.3273 0.3176 0.0174 0.3002 -85.9000 0.3907 0.3769 0.0148 0.3621 -86.0000 0.4574 0.4431 0.0130 0.4302 -86.1000 0.5296 0.5148 0.0116 0.5032 -86.2000 0.5940 0.5899 0.0105 0.5794 -86.3000 0.6568 0.6663 0.0096 0.6568 -86.4000 0.7327 0.7414 0.0088 0.7326 -86.5000 0.8006 0.8121 0.0081 0.8040 -86.6000 0.8542 0.8756 0.0075 0.8681 -86.7000 0.9042 0.9289 0.0070 0.9219 -86.8000 0.9473 0.9693 0.0065 0.9628 -86.9000 0.9788 0.9946 0.0061 0.9885 -87.0000 0.9945 1.0034 0.0057 0.9977 -87.1000 1.0000 0.9953 0.0053 0.9899 -87.2000 0.9871 0.9705 0.0050 0.9655 -87.3000 0.9491 0.9305 0.0047 0.9258 -87.4000 0.9019 0.8774 0.0045 0.8729 -87.5000 0.8362 0.8138 0.0042 0.8096 -87.6000 0.7645 0.7426 0.0040 0.7386 -87.7000 0.6929 0.6668 0.0038 0.6631 -87.8000 0.6044 0.5894 0.0036 0.5858 -87.9000 0.5020 0.5127 0.0034 0.5093 -88.0000 0.4170 0.4392 0.0032 0.4360 -88.1000 0.3477 0.3705 0.0031 0.3675 -88.2000 0.2851 0.3080 0.0029 0.3050 -88.3000 0.2304 0.2523 0.0028 0.2495 -88.4000 0.1870 0.2038 0.0027 0.2012 -88.5000 0.1495 0.1626 0.0026 0.1600 -88.6000 0.1161 0.1281 0.0025 0.1257 -88.7000 0.0895 0.0999 0.0023 0.0976 -88.8000 0.0689 0.0773 0.0023 0.0750 -88.9000 0.0504 0.0594 0.0022 0.0572 -89.0000 0.0382 0.0455 0.0021 0.0435 -89.1000 0.0290 0.0350 0.0020 0.0330 -89.2000 0.0298 0.0270 0.0019 0.0251 -89.3000 0.0286 0.0211 0.0018 0.0193 -89.4000 0.0264 0.0168 0.0018 0.0150 -89.5000 0.0244 0.0137 0.0017 0.0119 -89.6000 0.0216 0.0114 0.0017 0.0097 -89.7000 0.0189 0.0097 0.0016 0.0081 -89.8000 0.0157 0.0085 0.0015 0.0069 -89.9000 0.0135 0.0076 0.0015 0.0061 -90.0000 0.0126 0.0069 0.0014 0.0054 -90.1000 0.0115 0.0063 0.0014 0.0049 -90.2000 0.0104 0.0059 0.0014 0.0045 -90.3000 0.0100 0.0055 0.0013 0.0042 -90.4000 0.0108 0.0052 0.0013 0.0040 -90.5000 0.0104 0.0050 0.0012 0.0037 -90.6000 0.0097 0.0047 0.0012 0.0035 -90.7000 0.0079 0.0045 0.0012 0.0033 -90.8000 0.0050 0.0043 0.0011 0.0032 -90.9000 -0.0035 0.0041 0.0011 0.0030 -91.0000 -0.0093 0.0039 0.0011 0.0029 -91.1000 -0.0097 0.0038 0.0010 0.0027 -91.2000 -0.0090 0.0036 0.0010 0.0026 -91.3000 0.0011 0.0035 0.0010 0.0025 -91.4000 0.0067 0.0033 0.0009 0.0024 -91.5000 0.0129 0.0032 0.0009 0.0023 -91.6000 0.0192 0.0031 0.0009 0.0022 -91.7000 0.0207 0.0030 0.0009 0.0021 -91.8000 0.0192 0.0029 0.0009 0.0020 -91.9000 0.0130 0.0028 0.0008 0.0019 -92.0000 0.0061 0.0027 0.0008 0.0019 -92.1000 -0.0049 0.0026 0.0008 0.0018 -92.2000 -0.0120 0.0025 0.0008 0.0017 -92.3000 -0.0128 0.0024 0.0008 0.0017 -92.4000 -0.0128 0.0023 0.0007 0.0016 -92.5000 -0.0111 0.0023 0.0007 0.0016 -92.6000 0.0038 0.0022 0.0007 0.0015 -92.7000 0.0065 0.0021 0.0007 0.0014 -92.8000 0.0123 0.0021 0.0007 0.0014 -92.9000 0.0146 0.0020 0.0007 0.0014 -93.0000 0.0142 0.0020 0.0006 0.0013