#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-06-07 10:52:08 +0300 (Thu, 07 Jun 2018) $
#$Revision: 975 $
#$URL: svn://172.16.1.111/rod/cif/1/00/04/1000435.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_1000435
loop_
_publ_author_name
'Geiger, C. A.'
'Armbruster, T.'
'Khomenko, V.'
'Quartieri, S.'
_publ_section_title
;
 Cordierite I: The coordination of Fe2+ Sample: DA-1
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1255
_journal_page_last               1264
_journal_volume                  85
_journal_year                    2000
_chemical_compound_source        R040081
_chemical_formula_sum            'Al4 Fe0.14 Mg1.86 Na0.09 O18.58 Si5'
_chemical_name_mineral           Cordierite
_space_group_IT_number           66
_symmetry_space_group_name_Hall  '-C 2 2c'
_symmetry_space_group_name_H-M   'C c c m'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   17.072
_cell_length_b                   9.727
_cell_length_c                   9.351
_cell_volume                     1552.821
_exptl_crystal_density_diffrn    2.570
_cod_original_formula_sum        'Si5 Al4 (Mg1.86 Fe.14) Na.09 O18.58'
_cod_database_code               9002408
_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 other
_raman_measurement_device.excitation_laser_wavelength 532
_raman_measurement_device.configuration simple
_raman_measurement_device.resolution 4
_raman_measurement_device.power_on_sample 15
_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            R040081.rod
_rod_data_source.block           3500000
_rod_database.code               1000435
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 9002408 COD http://www.crystallography.net/cod/9002408.html
;
XRD analysis data was done.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
148.0349 0.0000000E+00
148.5170 3.449646
148.9991 5.833923
149.4813 4.877441
149.9634 1.045410
150.4455 0.3613280
150.9276 5.570801
151.4097 11.85291
151.8918 16.11017
152.3740 16.27496
152.8561 16.87140
153.3382 17.98126
153.8203 19.57635
154.3024 22.50146
154.7845 28.50684
155.2667 34.89172
155.7488 39.75244
156.2309 41.81525
156.7130 43.26544
157.1951 44.67297
157.6772 46.33295
158.1594 46.93268
158.6415 46.13422
159.1236 44.62170
159.6057 43.12573
160.0878 42.46362
160.5699 41.24298
161.0521 38.89874
161.5342 34.57825
162.0163 30.42401
162.4984 27.09967
162.9805 24.25525
163.4626 21.59235
163.9448 19.55481
164.4269 17.31024
164.9090 14.15942
165.3911 9.847412
165.8732 5.831360
166.3553 2.488831
166.8375 1.1047000E-02
167.3196 1.306030
167.8017 0.1645510
168.2838 1.452820
168.7659 2.457764
169.2480 1.244446
169.7302 0.1412960
170.2123 1.218079
170.6944 4.301880
171.1765 6.054321
171.6586 5.816040
172.1407 4.827393
172.6229 3.171631
173.1050 1.037048
173.5871 0.3438110
174.0692 1.015625
174.5513 4.212402
175.0334 6.555115
175.5156 5.512085
175.9977 2.922119
176.4798 1.380615
176.9619 1.392151
177.4440 2.332275
177.9261 4.318298
178.4083 6.970764
178.8904 8.608398
179.3725 7.057190
179.8546 3.723022
180.3367 2.212524
180.8188 4.024902
181.3010 6.795776
181.7831 7.173889
182.2652 5.716797
182.7473 4.548889
183.2294 5.440247
183.7115 7.696716
184.1937 8.843689
184.6758 7.977722
185.1579 6.241760
185.6400 5.602600
186.1221 6.025513
186.6042 6.784729
187.0864 7.871338
187.5685 8.998474
188.0506 8.555115
188.5327 5.342224
189.0148 1.139526
189.4969 0.3818970
189.9791 3.223267
190.4612 6.318848
190.9433 6.797607
191.4254 4.916504
191.9075 2.748474
192.3896 0.4015500
192.8718 1.707153
193.3539 2.086853
193.8360 0.5466920
194.3181 1.247192
194.8002 1.505737
195.2823 0.2800290
195.7645 0.2418820
196.2466 0.6790160
196.7287 2.610840
197.2108 3.733521
197.6929 3.877625
198.1750 3.880981
198.6572 4.795349
199.1393 6.679138
199.6214 7.693054
200.1035 7.029114
200.5856 5.070313
201.0677 4.227844
201.5499 4.716248
202.0320 5.603027
202.5141 6.025269
202.9962 5.960999
203.4783 5.731201
203.9604 5.443787
204.4426 5.093018
204.9247 4.421021
205.4068 3.300537
205.8889 2.313232
206.3710 1.988525
206.8531 2.469727
207.3353 2.970825
207.8174 3.452393
208.2995 3.876343
208.7816 3.508545
209.2637 2.039429
209.7458 0.3765870
210.2280 0.4654540
210.7101 0.2500000
211.1922 0.1353760
211.6743 0.3593750
212.1564 0.9304200
212.6385 1.871704
213.1207 3.512695
213.6028 5.010498
214.0849 5.356812
214.5670 4.158691
215.0491 3.036865
215.5313 2.354980
216.0134 2.105835
216.4955 1.919678
216.9776 1.971069
217.4597 1.836548
217.9418 0.9595950
218.4240 0.9870610
218.9061 2.761108
219.3882 4.019897
219.8703 4.741943
220.3524 5.740845
220.8345 7.055054
221.3167 8.570313
221.7988 10.29797
222.2809 12.49280
222.7630 14.23438
223.2451 15.15576
223.7272 15.25989
224.2094 15.72510
224.6915 16.54712
225.1736 17.72266
225.6557 19.49316
226.1378 22.52991
226.6199 24.62683
227.1021 24.84180
227.5842 23.16736
228.0663 23.39209
228.5484 26.36011
229.0305 30.31580
229.5126 33.71777
229.9948 36.56763
230.4769 38.77014
230.9590 39.89441
231.4411 39.89087
231.9232 41.41016
232.4053 44.99695
232.8875 49.45178
233.3696 53.61389
233.8517 56.61914
234.3338 61.09705
234.8159 67.96069
235.2980 77.22229
235.7802 85.41113
236.2623 92.14307
236.7444 98.24780
237.2265 104.4617
237.7086 111.2244
238.1907 117.3115
238.6729 122.8589
239.1550 127.7867
239.6371 130.6135
240.1192 130.7004
240.6013 129.3927
241.0834 127.8031
241.5656 126.4224
242.0477 123.6342
242.5298 118.2616
243.0119 110.7675
243.4940 106.2668
243.9761 106.3868
244.4583 107.5543
244.9404 107.1064
245.4225 103.7401
245.9046 101.3801
246.3867 100.5940
246.8688 101.1232
247.3510 101.8269
247.8331 102.9073
248.3152 104.1383
248.7973 105.3180
249.2794 105.9801
249.7615 107.6420
250.2437 110.5978
250.7258 114.5709
251.2079 118.3566
251.6900 121.2377
252.1721 125.2534
252.6542 131.7526
253.1364 141.8022
253.6185 151.4369
254.1006 160.0276
254.5827 168.1251
255.0648 177.4825
255.5469 188.0149
256.0291 199.7545
256.5112 212.9243
256.9933 228.3730
257.4754 243.4895
257.9575 258.9988
258.4396 273.9357
258.9218 285.4833
259.4039 294.8229
259.8860 298.8577
260.3681 296.3466
260.8502 287.2129
261.3323 270.7587
261.8145 244.2441
262.2966 212.1324
262.7787 183.5504
263.2608 158.9465
263.7429 136.7389
264.2250 115.6727
264.7072 95.16797
265.1893 78.88672
265.6714 67.55896
266.1535 59.94043
266.6356 54.21655
267.1177 50.90198
267.5999 47.90808
268.0820 44.39783
268.5641 40.26721
269.0462 36.86023
269.5283 34.43396
270.0104 32.34717
270.4926 29.47913
270.9747 25.45740
271.4568 21.84851
271.9389 19.38037
272.4210 18.19556
272.9031 16.91052
273.3853 15.43701
273.8674 13.95642
274.3495 12.66443
274.8316 11.49292
275.3137 10.75879
275.7958 10.79456
276.2780 11.53503
276.7601 11.35522
277.2422 9.836060
277.7243 8.401245
278.2064 8.964966
278.6885 11.84680
279.1707 13.76135
279.6528 13.68091
280.1349 12.01660
280.6170 10.71997
281.0991 9.725464
281.5812 9.431152
282.0634 10.75720
282.5455 13.81262
283.0276 15.52966
283.5097 14.93750
283.9918 12.87891
284.4739 11.92639
284.9561 12.14526
285.4382 12.99194
285.9203 14.14258
286.4024 15.57056
286.8845 17.24231
287.3666 19.14819
287.8488 21.22803
288.3309 23.41296
288.8130 25.69727
289.2951 27.87000
289.7772 29.91541
290.2593 31.75415
290.7415 32.94592
291.2236 33.23560
291.7057 33.32605
292.1878 34.42883
292.6699 36.48364
293.1520 38.67444
293.6342 41.03918
294.1163 43.25415
294.5984 43.93396
295.0805 42.86182
295.5626 41.01477
296.0447 39.45190
296.5269 38.13513
297.0090 36.84509
297.4911 35.34192
297.9732 33.80334
298.4553 32.56580
298.9374 31.61047
299.4196 31.10327
299.9017 32.12012
300.3838 33.83740
300.8659 33.94763
301.3480 29.90613
301.8301 24.52979
302.3123 22.12744
302.7944 22.60742
303.2765 24.01453
303.7586 25.31897
304.2407 26.37244
304.7228 26.95752
305.2050 27.04529
305.6871 26.60010
306.1692 25.38611
306.6513 23.50439
307.1334 21.52490
307.6155 19.56665
308.0977 17.81592
308.5798 16.61353
309.0619 16.43433
309.5440 16.09692
310.0261 14.60803
310.5082 12.16260
310.9904 9.362427
311.4725 5.650269
311.9546 2.176514
312.4367 4.3090999E-02
312.9188 0.3472900
313.4009 0.1343990
313.8831 3.6619999E-03
314.3652 0.2385250
314.8473 0.9709470
315.3294 3.836304
315.8115 6.189087
316.2936 5.890869
316.7758 2.300903
317.2579 0.8129880
317.7400 1.698730
318.2221 1.195557
318.7042 0.3941650
319.1863 0.8140870
319.6685 1.859741
320.1506 2.300415
320.6327 2.111328
321.1148 2.362427
321.5969 3.333618
322.0790 4.880005
322.5612 6.916626
323.0433 10.58459
323.5254 13.48645
324.0075 14.72571
324.4896 14.50891
324.9717 14.43555
325.4539 14.72034
325.9360 15.25671
326.4181 15.98853
326.9002 17.67297
327.3823 18.60278
327.8644 18.43237
328.3466 17.40283
328.8287 16.24268
329.3108 13.95410
329.7929 12.44446
330.2750 12.75732
330.7571 16.96130
331.2393 18.23938
331.7214 14.72302
332.2035 8.960815
332.6856 5.080444
333.1677 3.594116
333.6498 3.278320
334.1320 4.248657
334.6141 6.803101
335.0962 8.069458
335.5783 7.273560
336.0604 5.659790
336.5425 5.026978
337.0247 6.158081
337.5068 6.592773
337.9889 5.407349
338.4710 2.715210
338.9531 1.413086
339.4352 1.816895
339.9174 3.222778
340.3995 5.372925
340.8816 8.531250
341.3637 10.01880
341.8458 9.020996
342.3279 6.878662
342.8101 7.070435
343.2922 9.768433
343.7743 12.62915
344.2564 14.56738
344.7385 15.69763
345.2206 16.52222
345.7028 17.06531
346.1849 17.29077
346.6670 16.71155
347.1491 15.44666
347.6312 15.23596
348.1133 17.07214
348.5955 20.56335
349.0776 24.77539
349.5597 29.83435
350.0418 34.61023
350.5239 37.75830
351.0060 39.64307
351.4882 41.22620
351.9703 42.76184
352.4524 44.21460
352.9345 45.50427
353.4166 46.64551
353.8987 47.83813
354.3809 48.99426
354.8630 49.81958
355.3451 50.10596
355.8272 49.30115
356.3093 48.95422
356.7914 51.05701
357.2736 54.84265
357.7557 58.16724
358.2378 59.31958
358.7199 59.79993
359.2020 60.75720
359.6841 62.30701
360.1663 64.38696
360.6484 67.07056
361.1305 70.22913
361.6126 73.68738
362.0947 78.15662
362.5768 82.23865
363.0590 84.74854
363.5411 85.71094
364.0232 87.90247
364.5053 93.83752
364.9874 100.5217
365.4695 105.6345
365.9517 108.3600
366.4338 109.8623
366.9159 110.5044
367.3980 110.1603
367.8801 108.3098
368.3622 104.7751
368.8444 99.80322
369.3265 93.26904
369.8086 83.37732
370.2907 75.09607
370.7728 69.31604
371.2549 64.85425
371.7371 59.82471
372.2192 53.71655
372.7013 47.69116
373.1834 41.99731
373.6655 36.57227
374.1476 31.82703
374.6298 27.81421
375.1119 24.54370
375.5940 22.16663
376.0761 20.97144
376.5582 19.96814
377.0403 19.09668
377.5225 18.29370
378.0046 17.12659
378.4867 15.46802
378.9688 13.99707
379.4509 13.44275
379.9330 13.84009
380.4152 13.23303
380.8973 11.15942
381.3794 8.593628
381.8615 7.218994
382.3436 6.995117
382.8257 7.048828
383.3079 7.158081
383.7900 7.227051
384.2721 6.813354
384.7542 5.869385
385.2363 4.953857
385.7184 4.758789
386.2006 5.045288
386.6827 5.198364
387.1648 5.164673
387.6469 4.774780
388.1290 3.420532
388.6111 1.330200
389.0933 0.2747800
389.5754 0.2564700
390.0575 0.5628660
390.5396 1.353760
391.0217 2.175903
391.5038 2.385498
391.9860 0.5845950
392.4681 2.063232
392.9502 3.452271
393.4323 0.6279300
393.9144 2.126953
394.3965 1.581787
394.8787 2.642944
395.3608 5.676636
395.8429 4.691528
396.3250 2.278564
396.8071 0.7481690
397.2892 1.809692
397.7714 2.501953
398.2535 1.593750
398.7356 0.4477540
399.2177 1.274292
399.6998 1.153931
400.1819 3.351440
400.6641 3.675537
401.1462 0.6452640
401.6283 1.207764
402.1104 1.244873
402.5925 0.3931880
403.0746 5.5420000E-02
403.5568 0.3808590
404.0389 0.9470210
404.5210 1.798462
405.0031 2.930420
405.4852 3.321899
405.9673 2.605469
406.4495 1.836426
406.9316 2.143433
407.4137 3.765991
407.8958 4.615601
408.3779 4.206543
408.8600 3.067627
409.3422 2.698853
409.8243 3.182373
410.3064 3.239136
410.7885 1.083008
411.2706 2.403931
411.7527 2.310303
412.2349 2.016724
412.7170 7.146973
413.1991 8.585205
413.6812 7.364868
414.1633 6.873779
414.6454 8.744507
415.1276 11.66663
415.6097 14.50293
416.0918 17.07520
416.5739 18.35791
417.0560 16.31555
417.5381 13.11743
418.0203 11.45557
418.5024 12.36450
418.9845 13.57886
419.4666 13.65125
419.9487 13.03088
420.4308 12.54346
420.9130 12.21814
421.3951 12.36609
421.8772 13.10803
422.3593 14.43311
422.8414 16.46326
423.3235 20.29358
423.8057 24.27100
424.2878 27.02649
424.7699 27.64587
425.2520 27.89246
425.7341 27.23938
426.2162 26.21326
426.6984 26.86096
427.1805 31.36780
427.6626 34.99597
428.1447 35.38501
428.6268 30.77124
429.1089 29.83643
429.5911 35.23279
430.0732 41.49707
430.5553 41.06848
431.0374 31.92395
431.5195 24.06543
432.0016 19.83020
432.4838 18.61768
432.9659 17.75037
433.4480 17.27209
433.9301 16.81909
434.4122 16.46179
434.8943 16.05481
435.3765 14.26184
435.8586 10.64490
436.3407 6.617920
436.8228 3.852905
437.3049 2.307983
437.7870 1.807007
438.2692 3.143799
438.7513 5.094604
439.2334 5.907593
439.7155 5.629517
440.1976 4.964355
440.6797 3.571167
441.1619 2.413086
441.6440 2.873047
442.1261 6.265747
442.6082 9.483521
443.0903 10.83716
443.5724 10.68494
444.0546 9.803589
444.5367 6.638184
445.0188 4.332764
445.5009 4.998169
445.9830 9.248779
446.4651 12.29944
446.9473 12.20129
447.4294 11.19592
447.9115 11.15637
448.3936 13.65686
448.8757 15.22534
449.3578 15.20374
449.8400 14.12671
450.3221 13.63049
450.8042 14.33337
451.2863 14.93396
451.7684 14.34021
452.2505 12.03687
452.7327 12.30017
453.2148 16.24170
453.6969 20.74097
454.1790 21.34705
454.6611 17.85999
455.1432 14.98303
455.6254 13.60608
456.1075 13.75842
456.5896 16.27100
457.0717 21.02307
457.5538 25.63098
458.0359 29.49231
458.5181 32.01685
459.0002 31.44507
459.4823 27.16101
459.9644 22.12598
460.4465 19.26270
460.9286 17.83569
461.4108 16.56726
461.8929 14.63416
462.3750 13.04150
462.8571 12.62280
463.3392 13.21680
463.8214 14.14502
464.3035 15.63403
464.7856 17.02417
465.2677 17.75403
465.7498 17.35583
466.2319 17.41565
466.7141 19.04651
467.1962 21.10999
467.6783 22.16565
468.1604 20.50806
468.6425 19.47913
469.1246 19.64941
469.6068 21.07800
470.0889 22.55652
470.5710 24.05774
471.0531 25.17200
471.5352 25.54443
472.0173 24.83960
472.4995 24.63379
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