#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-04-26 13:29:16 +0300 (Thu, 26 Apr 2018) $
#$Revision: 487 $
#$URL: svn://172.16.1.111/rod/cif/1/00/00/1000042.rod $
#------------------------------------------------------------------------------
#
# This file is available in the Raman Open Database (ROD),
# http://solsa.crystallography.net/rod/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_1000042
loop_
_publ_author_name
'Peacor, D. R.'
'Buerger, M. J.'
_publ_section_title
;
 The determination and refinement of the structure of narsarsukite,
 Na2TiOSi4O10
;
_journal_name_full               'American Mineralogist'
_journal_page_first              539
_journal_page_last               556
_journal_volume                  47
_journal_year                    1962
_chemical_compound_source        R060203
_chemical_formula_sum            'Na4 O22 Si8 Ti2'
_chemical_name_mineral           Narsarsukite
_space_group_IT_number           87
_symmetry_space_group_name_Hall  '-I 4'
_symmetry_space_group_name_H-M   'I 4/m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   10.7269
_cell_length_b                   10.7269
_cell_length_c                   7.9476
_cell_volume                     914.502
_exptl_crystal_density_diffrn    2.776
_cod_original_formula_sum        'Ti Na2 Si4 O11'
_cod_database_code               9000110
_raman_determination_method      experimental
_raman_measurement_device.location 'Arizona University'
_raman_measurement_device.company 'Thermo Scientific'
_raman_measurement_device.model  'Nicolet Almega XR'
_raman_measurement_device.optics_type microscope
_raman_measurement_device.microscope_system dispersive
_raman_measurement_device.microscope_objective_magnification 50
_raman_measurement_device.microscope_numerical_aperture 0.5
_raman_measurement_device.excitation_laser_type helium-neon
_raman_measurement_device.excitation_laser_wavelength 780
_raman_measurement_device.configuration simple
_raman_measurement_device.resolution 4
_raman_measurement_device.power_on_sample 12
_raman_measurement_device.direction_polarization unoriented
_raman_measurement_device.spot_size 1
_raman_measurement_device.diffraction_grating 400
_raman_measurement.environment   Air
_raman_measurement.environment_details
;
 The sample was measured in air.
;
_raman_measurement.temperature   300
_raman_measurement.pressure      100
_raman_measurement.background_subtraction no
_raman_measurement.background_subtraction_details
;
 No background subtraction method was applied.
;
_raman_measurement.baseline_correction no
_raman_measurement.baseline_correction_details
;
 No baseline correction method was applied.
;
_raman_measurement.integration_time 10
_rod_data_source.file            R060203.rod
_rod_data_source.block           3500000
_rod_database.code               1000042
loop_
_raman_complementary.id
_raman_complementary.method
1 XRD
loop_
_raman_measurement_device_calibration.id
_raman_measurement_device_calibration.standard
1 neon_lamp
loop_
_rod_related_entry.id
_rod_related_entry.code
_rod_related_entry.database
_rod_related_entry.uri
_rod_related_entry.description
1 9000110 COD http://www.crystallography.net/cod/9000110.html
;
XRD analysis data was done.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
135.2177 0.0000000E+00
135.6998 42.75244
136.1819 89.91345
136.6640 135.3907
137.1461 172.4711
137.6282 201.9720
138.1104 219.3260
138.5925 221.2863
139.0746 203.6812
139.5567 190.2175
140.0388 176.0290
140.5209 146.6115
141.0031 111.1050
141.4852 78.67078
141.9673 51.61304
142.4494 29.99652
142.9315 13.19604
143.4136 1.015564
143.8958 6.364319
144.3779 8.946167
144.8600 7.664673
145.3421 3.833740
145.8242 3.147400
146.3063 12.27002
146.7885 23.25171
147.2706 36.33191
147.7527 51.60077
148.2348 68.96881
148.7169 88.99127
149.1990 113.3177
149.6812 141.1960
150.1633 173.1104
150.6454 208.7028
151.1275 248.4385
151.6096 292.7689
152.0917 340.6597
152.5739 395.8943
153.0560 460.9990
153.5381 536.0817
154.0202 619.5900
154.5023 712.1724
154.9844 814.2414
155.4665 918.6290
155.9487 1029.464
156.4308 1136.588
156.9129 1232.024
157.3950 1314.179
157.8771 1382.658
158.3592 1434.567
158.8414 1463.645
159.3235 1491.579
159.8056 1523.983
160.2877 1557.464
160.7698 1591.772
161.2519 1627.324
161.7341 1659.624
162.2162 1676.136
162.6983 1681.077
163.1804 1660.191
163.6625 1610.832
164.1446 1536.964
164.6268 1440.949
165.1089 1322.589
165.5910 1186.201
166.0731 1054.435
166.5552 922.1515
167.0373 799.5987
167.5195 687.0108
168.0016 585.4387
168.4837 496.3762
168.9658 421.4320
169.4479 359.8550
169.9300 307.4486
170.4122 264.5883
170.8943 227.1018
171.3764 194.3669
171.8585 165.7966
172.3406 140.4024
172.8227 117.7913
173.3049 98.56525
173.7870 82.11484
174.2691 69.68689
174.7512 59.55365
175.2333 49.86365
175.7154 40.55341
176.1976 32.54324
176.6797 26.90808
177.1618 23.52444
177.6439 22.12881
178.1260 22.66977
178.6081 23.75302
179.0903 24.00003
179.5724 22.96893
180.0545 22.95139
180.5366 26.10281
181.0187 31.13364
181.5008 36.01035
181.9830 39.33325
182.4651 41.94601
182.9472 46.47543
183.4293 53.71237
183.9114 61.90265
184.3935 70.70291
184.8757 79.73651
185.3578 88.28513
185.8399 95.79944
186.3220 102.4431
186.8041 109.3850
187.2862 116.6960
187.7684 124.2017
188.2505 132.5515
188.7326 141.1016
189.2147 148.7578
189.6968 154.8514
190.1789 159.4905
190.6611 161.1458
191.1432 159.0289
191.6253 154.7447
192.1074 148.3342
192.5895 140.0867
193.0716 132.2190
193.5538 123.2198
194.0359 112.9247
194.5180 101.8996
195.0001 88.63489
195.4822 76.08420
195.9643 65.80637
196.4465 57.69708
196.9286 50.49826
197.4107 43.03696
197.8928 35.20786
198.3749 28.80856
198.8570 24.48242
199.3392 21.00836
199.8213 17.61673
200.3034 14.20538
200.7855 10.84232
201.2676 7.424896
201.7497 3.798370
202.2319 0.9239200
202.7140 0.2028500
203.1961 0.5902100
203.6782 1.375366
204.1603 2.940155
204.6424 4.326019
205.1246 4.512573
205.6067 3.736908
206.0888 3.007599
206.5709 2.769501
207.0530 2.686340
207.5351 2.196381
208.0173 1.130280
208.4994 0.1718750
208.9815 4.7516000E-02
209.4636 0.2415160
209.9457 0.6322330
210.4278 1.102356
210.9100 1.564819
211.3921 1.756042
211.8742 1.451172
212.3563 1.346222
212.8384 2.124023
213.3205 3.366669
213.8027 4.304810
214.2848 4.430054
214.7669 3.954315
215.2490 3.615234
215.7311 3.508423
216.2132 3.392487
216.6954 3.029755
217.1775 2.599396
217.6596 2.412903
218.1417 2.675262
218.6238 3.334290
219.1059 4.153748
219.5881 5.918579
220.0702 6.768616
220.5523 5.645355
221.0344 3.362396
221.5165 1.209534
221.9986 4.2725001E-02
222.4808 0.2411190
222.9629 0.5948490
223.4450 0.7566830
223.9271 1.307861
224.4092 2.581360
224.8913 4.306213
225.3735 6.014801
225.8556 7.384216
226.3377 8.459656
226.8198 9.827454
227.3019 11.89938
227.7840 13.83173
228.2662 15.41855
228.7483 16.74063
229.2304 17.99130
229.7125 19.32404
230.1946 20.68680
230.6767 21.47147
231.1589 20.77100
231.6410 20.50632
232.1231 21.53802
232.6052 23.30933
233.0873 24.55807
233.5694 24.39301
234.0516 23.18484
234.5337 23.67206
235.0158 27.51782
235.4979 30.91022
235.9800 32.72562
236.4621 33.27710
236.9443 33.10947
237.4264 32.29736
237.9085 31.22321
238.3906 31.66837
238.8727 34.62155
239.3548 37.66339
239.8370 40.09772
240.3191 42.00290
240.8012 43.42410
241.2833 44.16492
241.7654 44.71722
242.2475 46.52316
242.7297 50.02875
243.2118 53.80542
243.6939 57.15643
244.1760 60.23441
244.6581 63.54773
245.1402 67.34875
245.6224 71.45050
246.1045 75.46555
246.5866 79.29871
247.0687 83.26578
247.5508 87.40280
248.0329 91.76315
248.5151 96.61237
248.9972 102.1245
249.4793 108.1518
249.9614 114.2888
250.4435 120.4661
250.9256 127.1721
251.4078 134.8641
251.8899 143.3806
252.3720 152.1862
252.8541 160.9151
253.3362 170.1560
253.8183 180.3466
254.3005 191.4895
254.7826 203.3787
255.2647 215.4162
255.7468 227.8936
256.2289 242.3589
256.7110 259.3441
257.1931 278.2497
257.6753 298.4298
258.1574 319.7706
258.6395 341.6022
259.1216 362.6456
259.6037 383.4237
260.0858 407.4365
260.5680 436.3271
261.0501 466.8969
261.5322 496.8509
262.0143 526.5090
262.4964 557.0391
262.9785 590.3975
263.4607 625.7490
263.9428 658.7660
264.4249 689.1414
264.9070 716.8910
265.3891 743.1001
265.8712 767.2213
266.3534 788.0533
266.8355 805.3992
267.3176 818.7862
267.7997 826.4428
268.2818 828.1891
268.7639 823.4559
269.2461 812.6683
269.7282 796.4135
270.2103 775.2140
270.6924 748.9357
271.1745 718.2415
271.6566 685.5856
272.1388 650.8365
272.6209 614.5590
273.1030 575.4798
273.5851 535.6451
274.0672 497.8438
274.5493 463.1792
275.0315 430.9762
275.5136 399.7329
275.9957 368.6154
276.4778 340.0172
276.9599 314.2538
277.4420 290.6163
277.9242 268.7047
278.4063 248.3765
278.8884 229.6216
279.3705 212.1660
279.8526 196.3430
280.3347 181.0730
280.8169 165.1703
281.2990 150.3177
281.7811 138.2013
282.2632 129.0900
282.7453 121.5501
283.2274 113.4199
283.7096 103.9905
284.1917 95.89078
284.6738 89.42062
285.1559 83.89331
285.6380 79.32544
286.1201 75.49384
286.6023 71.62860
287.0844 66.53702
287.5665 59.41476
288.0486 54.47784
288.5307 52.83759
289.0128 52.16928
289.4950 51.76260
289.9771 51.44675
290.4592 51.18839
290.9413 50.89957
291.4234 50.52551
291.9055 50.74963
292.3877 52.04202
292.8698 53.48199
293.3519 54.83698
293.8340 56.09915
294.3161 57.20950
294.7982 58.00888
295.2804 58.63089
295.7625 60.77301
296.2446 65.07742
296.7267 70.37320
297.2088 76.71445
297.6909 83.86548
298.1731 91.57846
298.6552 99.70914
299.1373 108.1310
299.6194 116.3096
300.1015 123.0958
300.5836 131.0745
301.0658 140.7464
301.5479 151.5001
302.0300 162.7090
302.5121 174.0849
302.9942 185.8336
303.4763 198.6503
303.9585 213.4927
304.4406 227.8807
304.9227 241.5827
305.4048 254.9503
305.8869 268.5218
306.3690 282.3000
306.8512 295.7596
307.3333 308.3547
307.8154 320.8318
308.2975 330.0270
308.7796 336.7070
309.2617 340.2282
309.7439 339.8423
310.2260 335.7598
310.7081 328.9409
311.1902 320.3430
311.6723 309.9171
312.1544 297.3433
312.6366 282.1245
313.1187 265.5701
313.6008 247.3054
314.0829 228.0121
314.5650 208.8442
315.0471 190.5778
315.5293 173.2813
316.0114 157.9768
316.4935 145.4470
316.9756 133.9399
317.4577 123.4961
317.9398 113.8199
318.4220 104.5272
318.9041 95.41785
319.3862 86.61057
319.8683 78.39423
320.3504 71.11707
320.8326 64.16791
321.3147 57.23633
321.7968 50.75702
322.2789 45.23911
322.7610 40.85388
323.2431 37.11441
323.7253 33.23047
324.2074 28.94611
324.6895 25.02383
325.1716 21.25906
325.6537 17.92004
326.1358 15.24313
326.6180 13.21411
327.1001 11.56885
327.5822 10.03860
328.0643 8.634552
328.5464 7.284882
329.0285 6.071045
329.5107 4.827454
329.9928 3.460052
330.4749 1.998474
330.9570 0.5047610
331.4391 1.014130
331.9212 2.527008
332.4034 3.558594
332.8855 3.755402
333.3676 3.826599
333.8497 3.781342
334.3318 3.718353
334.8139 3.780182
335.2961 4.043182
335.7782 4.411560
336.2603 4.617401
336.7424 4.674957
337.2245 4.515289
337.7066 4.060455
338.1888 3.447937
338.6709 2.806152
339.1530 2.163574
339.6351 1.448059
340.1172 0.4609990
340.5993 0.8395080
341.0815 2.297974
341.5636 3.919250
342.0457 5.678894
342.5278 7.513855
343.0099 9.447662
343.4920 11.58768
343.9742 14.06024
344.4563 16.88983
344.9384 19.70245
345.4205 22.74362
345.9026 25.39792
346.3847 26.58243
346.8669 27.25104
347.3490 29.33215
347.8311 34.24707
348.3132 41.07947
348.7953 45.86435
349.2774 47.28171
349.7596 48.52301
350.2417 49.76877
350.7238 51.54425
351.2059 54.38470
351.6880 58.46365
352.1701 63.15668
352.6523 67.27942
353.1344 70.34521
353.6165 74.35757
354.0986 79.63184
354.5807 85.79739
355.0628 92.80563
355.5450 100.5765
356.0271 108.8642
356.5092 117.3539
356.9913 125.9680
357.4734 135.5652
357.9555 147.1726
358.4377 158.6333
358.9198 169.5283
359.4019 179.5796
359.8840 188.2893
360.3661 195.3555
360.8482 200.8877
361.3304 205.5824
361.8125 210.2967
362.2946 212.0546
362.7767 208.6456
363.2588 202.5750
363.7409 196.0190
364.2231 189.4875
364.7052 183.2642
365.1873 177.5449
365.6694 172.2443
366.1515 168.0386
366.6336 165.3457
367.1158 163.6946
367.5979 162.6699
368.0800 162.2689
368.5621 162.7984
369.0442 164.4179
369.5263 167.1324
370.0085 171.0443
370.4906 176.4050
370.9727 182.5777
371.4548 189.3004
371.9369 196.4301
372.4190 203.7771
372.9012 211.2051
373.3833 218.8093
373.8654 226.8953
374.3475 235.5240
374.8296 243.8674
375.3117 251.6340
375.7939 258.7175
376.2760 264.9771
376.7581 270.2438
377.2402 275.1165
377.7223 280.9384
378.2044 287.0128
378.6866 290.1557
379.1687 289.0760
379.6508 285.3978
380.1329 281.1516
380.6150 276.4368
381.0971 270.2900
381.5793 261.8221
382.0614 251.9359
382.5435 241.9047
383.0256 231.8380
383.5077 221.3713
383.9898 209.7736
384.4720 197.3468
384.9541 185.8328
385.4362 175.9115
385.9183 166.4078
386.4004 156.7445
386.8825 146.9611
387.3647 136.9446
387.8468 126.5146
388.3289 116.1202
388.8110 107.1019
389.2931 99.96356
389.7752 92.56274
390.2574 84.17578
390.7395 75.48083
391.2216 67.18875
391.7037 59.48465
392.1858 52.19452
392.6679 45.07135
393.1501 37.95184
393.6322 32.13904
394.1143 28.64435
394.5964 25.41141
395.0785 21.31546
395.5606 16.52429
396.0428 11.75906
396.5249 7.411499
397.0070 3.524017
397.4891 0.2172240
397.9712 2.127167
398.4533 4.295685
398.9355 6.395660
399.4176 8.399292
399.8997 10.29477
400.3818 12.07092
400.8639 13.72388
401.3460 15.29959
401.8282 17.01703
402.3103 18.00226
402.7924 18.37515
403.2745 18.03525
403.7566 16.59213
404.2387 14.33664
404.7209 12.05838
405.2030 10.44702
405.6851 9.322998
406.1672 7.398804
406.6493 4.542969
407.1314 0.9862980
407.6136 3.783569
408.0957 8.896088
408.5778 13.18118
409.0599 16.19708
409.5420 19.09882
410.0241 23.79315
410.5063 30.63431
410.9884 37.25497
411.4705 42.75800
411.9526 48.41769
412.4347 54.33759
412.9168 60.83578
413.3990 69.05161
413.8811 80.32214
414.3632 93.96429
414.8453 107.1817
415.3274 119.2280
415.8095 132.7162
416.2917 148.7519
416.7738 167.1585
417.2559 188.0190
417.7380 211.3339
418.2201 237.2067
418.7022 265.9825
419.1844 297.6034
419.6665 331.8927
420.1486 369.6682
420.6307 408.7978
421.1128 446.6363
421.5949 483.5423
422.0771 518.9946
422.5592 555.9556
423.0413 589.9694
423.5234 615.9857
424.0055 633.3931
424.4876 641.3756
424.9698 638.5140
425.4519 624.6538
425.9340 604.8895
426.4161 576.8478
426.8982 545.6868
427.3803 512.0920
427.8625 477.2000
428.3446 443.1270
428.8267 410.3929
429.3088 379.8470
429.7909 352.9783
430.2730 330.6256
430.7552 310.7624
431.2373 294.3792
431.7194 279.8258
432.2015 265.8005
432.6836 252.4227
433.1657 240.5214
433.6479 230.7722
434.1300 223.1817
434.6121 217.7469
435.0942 215.7121
435.5763 214.4855
436.0584 213.7749
436.5406 213.6240
437.0227 213.9741
437.5048 214.8418
437.9869 216.5948
438.4690 219.9362
438.9511 225.2789
439.4333 230.8731
439.9154 236.4825
440.3975 242.5778
440.8796 249.4191
441.3617 256.9360
441.8438 264.9312
442.3260 273.3669
442.8081 282.0974
443.2902 290.2984
443.7723 297.7168
444.2544 305.3393
444.7365 314.3611
445.2187 323.3138
445.7008 330.7483
446.1829 336.3561
446.6650 340.8219
447.1471 345.1641
447.6292 349.0210
448.1114 350.2811
448.5935 348.2377
449.0756 344.2691
449.5577 339.7881
450.0398 334.4685
450.5219 326.7307
451.0041 315.1486
451.4862 301.6979
451.9683 288.7385
452.4504 275.9228
452.9325 260.7395
453.4146 241.5073
453.8968 219.9464
454.3789 199.4811
454.8610 179.8904
455.3431 161.7215
455.8252 145.8920
456.3073 131.1739
456.7895 115.8624
457.2716 99.87946
457.7537 84.57333
458.2358 70.99338
458.7179 59.12820
459.2000 48.87234
459.6822 40.03076
460.1643 32.71393
460.6464 27.06900
461.1285 22.99774
461.6106 20.31802
462.0927 18.99597
462.5748 19.35410
463.0569 21.98331
463.5391 27.25693
464.0212 33.76221
464.5033 41.82861
464.9854 50.82233
465.4675 61.57419
465.9496 72.88885
466.4318 82.60733
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