#------------------------------------------------------------------------------
#$Date: 2018-01-05 14:55:17 +0200 (Fri, 05 Jan 2018) $
#$Revision: 361 $
#$URL: svn://172.16.1.111/rod/cif/3/50/00/3500033.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_3500033
loop_
_publ_author_name
'El Mendili, Y'
_publ_section_title
;
 Raman spectrum of goethite from granite SOLSA sample
;
_journal_name_full               'Personal communication to ROD'
_journal_year                    2017
_chemical_compound_source        'SOLSA Tiebaghi HSA'
_chemical_formula_structural     'Fe H O2'
_chemical_formula_sum            'Fe H O2'
_chemical_name_mineral           Goethite
_chemical_name_systematic        Goethite
_space_group_IT_number           62
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_length_a                   9.9134
_cell_length_b                   3.0128
_cell_length_c                   4.5800
_cell_volume                     136.791
_raman_determination_method      experimental
_[local]_chemical_compound_color black
_[local]_chemical_compound_state Solid
_raman_measurement_device.location ENSICAEN
_raman_measurement_device.company 'Thermo Scientific'
_raman_measurement_device.model  DXR
_raman_measurement_device.optics_type microscope
_raman_measurement_device.microscope_system dispersive
_raman_measurement_device.microscope_objective_magnification 20
_raman_measurement_device.microscope_numerical_aperture 0.25
_raman_measurement_device.excitation_laser_type other
_raman_measurement_device.excitation_laser_wavelength 532
_raman_measurement_device.configuration simple
_raman_measurement_device.resolution 3
_raman_measurement_device.power_on_sample 1
_raman_measurement_device.direction_polarization unoriented
_raman_measurement_device.spot_size 1.3
_raman_measurement_device.diffraction_grating 900
_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 100
_raman_measurement.range_min     49.93432
_raman_measurement.range_max     2500.051
_rod_data_source.file            Goethite.rod
_rod_data_source.block           1000000
_rod_database.code               3500033
_solsa_sample.id                 CN-MB00-0001
_raman_measurement.datetime_initiated 2017-06-12
loop_
_raman_complementary.id
_raman_complementary.method
1 EDX
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 9002158 COD http://www.crystallography.net/cod/9002158.html
;
no XRD analysis data.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
49.93432 12.66544
50.89856 11.7534
51.86279 11.43827
52.82702 11.17796
53.79126 10.54317
54.75549 9.33521
55.71972 8.76844
56.68396 9.12238
57.64819 9.93595
58.61242 10.50398
59.57666 10.62245
60.54089 10.34402
61.50512 9.58378
62.46936 8.4801
63.43359 7.46341
64.39782 6.62057
65.36205 6.09263
66.32629 5.91954
67.29052 6.11792
68.25475 6.75757
69.21899 8.30204
70.18322 10.27786
71.14745 11.96602
72.11169 12.53255
73.07592 11.50532
74.04015 10.98268
75.00439 10.99694
75.96862 11.4477
76.93285 12.05898
77.89709 12.70636
78.86132 14.51965
79.82555 17.26867
80.78979 20.88801
81.75402 26.46911
82.71825 33.43239
83.68249 42.68211
84.64672 55.63499
85.61095 73.33352
86.57519 92.92822
87.53942 114.344
88.50365 134.2583
89.46789 148.2489
90.43212 150.1075
91.39635 138.0898
92.36059 121.7593
93.32482 100.2668
94.28905 75.19611
95.25329 55.00814
96.21752 41.46434
97.18176 30.44403
98.14599 21.81697
99.11022 15.80805
100.0745 11.41947
101.0387 8.8959
102.0029 7.4536
102.9672 6.77899
103.9314 6.65469
104.8956 6.6569
105.8599 6.56139
106.8241 6.42889
107.7883 6.39327
108.7526 6.72415
109.7168 7.39546
110.681 7.74851
111.6453 7.71822
112.6095 7.31362
113.5737 6.61017
114.5379 5.28413
115.5022 3.92846
116.4664 2.58006
117.4306 1.22851
118.3949 0.26596
119.3591 -0.00904
120.3233 -0.06667
121.2876 -0.11172
122.2518 -0.25815
123.216 -0.52323
124.1803 -0.89635
125.1445 -1.28643
126.1087 -1.58779
127.073 -1.65637
128.0372 -1.52053
129.0014 -1.34838
129.9657 -1.18669
130.9299 -1.16195
131.8941 -1.65573
132.8584 -3.0193
133.8226 -4.00658
134.7868 -4.24781
135.7511 -3.70723
136.7153 -3.25618
137.6796 -2.58945
138.6438 -2.01246
139.608 -1.75204
140.5723 -1.96676
141.5365 -2.2597
142.5007 -2.81717
143.465 -3.31707
144.4292 -3.35573
145.3934 -2.46174
146.3577 -1.02542
147.3219 0.00607
148.2861 0.55205
149.2504 0.53078
150.2146 -0.17542
151.1788 -1.54624
152.1431 -2.2406
153.1073 -1.99236
154.0715 -1.00054
155.0358 -0.31581
156 -0.8635
156.9642 -0.90875
157.9285 0.25612
158.8927 2.71713
159.8569 4.91152
160.8212 6.08969
161.7854 6.63175
162.7496 6.6503
163.7139 6.23893
164.6781 5.46686
165.6423 4.22422
166.6066 2.81384
167.5708 1.55891
168.535 0.77793
169.4993 0.55443
170.4635 0.59587
171.4277 0.94642
172.392 1.44101
173.3562 1.77295
174.3204 1.69977
175.2847 1.6303
176.2489 1.54125
177.2131 1.42434
178.1774 1.28268
179.1416 0.86491
180.1058 0.60816
181.0701 0.83295
182.0343 1.58726
182.9985 2.58498
183.9628 3.56713
184.927 4.31694
185.8912 4.46561
186.8555 3.85999
187.8197 2.6953
188.7839 2.54251
189.7482 3.32928
190.7124 4.44251
191.6766 5.34994
192.6409 5.7832
193.6051 5.95953
194.5693 5.77665
195.5336 5.79941
196.4978 6.6604
197.462 9.09751
198.4263 11.32767
199.3905 12.3324
200.3547 12.77645
201.319 13.84345
202.2832 17.84818
203.2474 21.61519
204.2117 22.41665
205.1759 20.45714
206.1401 16.98899
207.1044 14.74181
208.0686 13.48949
209.0328 12.42568
209.9971 11.35661
210.9613 10.33172
211.9255 9.99428
212.8898 10.86566
213.854 11.88165
214.8182 12.61941
215.7825 12.905
216.7467 13.0789
217.7109 13.64042
218.6752 14.09482
219.6394 14.03196
220.6036 13.19652
221.5679 12.60098
222.5321 13.26589
223.4963 14.42695
224.4606 15.3776
225.4248 15.4635
226.389 14.78168
227.3533 14.55473
228.3175 14.88125
229.2817 15.69269
230.246 16.83893
231.2102 18.40382
232.1744 20.43444
233.1387 22.76552
234.1029 25.25729
235.0671 27.76441
236.0314 30.48848
236.9956 33.20905
237.9598 36.16216
238.9241 39.11455
239.8883 41.6109
240.8525 43.2397
241.8168 43.92136
242.781 43.40674
243.7452 41.84059
244.7095 39.63736
245.6737 37.71883
246.6379 35.9726
247.6022 34.28089
248.5664 32.59871
249.5306 30.95392
250.4949 29.69467
251.4591 28.89042
252.4233 27.92044
253.3876 26.61927
254.3518 25.01089
255.316 23.23305
256.2802 21.18835
257.2445 19.47487
258.2087 18.31851
259.1729 17.75694
260.1372 17.62307
261.1014 17.96
262.0656 18.36465
263.0299 18.47615
263.9941 18.02858
264.9583 17.21693
265.9226 16.76636
266.8868 16.63017
267.851 16.75217
268.8153 17.08314
269.7795 17.73748
270.7437 18.29247
271.708 18.78648
272.6722 19.13032
273.6364 19.1406
274.6007 18.3143
275.5649 18.02164
276.5291 18.87645
277.4934 20.40625
278.4576 21.92719
279.4218 22.64768
280.3861 23.32329
281.3503 24.91415
282.3145 27.30532
283.2788 29.9207
284.243 31.53581
285.2072 31.99397
286.1715 33.73637
287.1357 37.07261
288.0999 41.68136
289.0642 46.54251
290.0284 51.69542
290.9926 57.98824
291.9569 65.9329
292.9211 75.28516
293.8853 84.83461
294.8496 96.04069
295.8138 104.525
296.778 108.9884
297.7423 109.2576
298.7065 106.2568
299.6707 99.11604
300.635 90.33989
301.5992 81.87183
302.5634 74.42363
303.5277 67.88808
304.4919 61.79946
305.4561 55.86005
306.4204 51.23288
307.3846 48.70295
308.3488 48.34423
309.3131 47.2429
310.2773 45.24236
311.2415 43.13131
312.2058 41.04601
313.17 39.03559
314.1342 37.37231
315.0985 36.1087
316.0627 34.92873
317.0269 33.82084
317.9912 32.85673
318.9554 32.21393
319.9196 32.05015
320.8839 32.17693
321.8481 32.44175
322.8123 32.70907
323.7766 32.8737
324.7408 32.87114
325.705 32.89101
326.6693 32.79067
327.6335 32.36719
328.5977 31.46365
329.562 31.28592
330.5262 32.44097
331.4904 33.67799
332.4547 34.22255
333.4189 33.74423
334.3831 33.25126
335.3474 33.60423
336.3116 34.40631
337.2758 35.31276
338.2401 36.08459
339.2043 36.83991
340.1685 38.32059
341.1328 40.27724
342.097 42.00829
343.0612 42.98958
344.0255 43.11161
344.9897 43.71934
345.9539 44.54349
346.9182 45.71104
347.8824 47.47279
348.8466 50.12494
349.8109 52.34123
350.7751 53.72852
351.7393 54.99772
352.7036 56.57381
353.6678 58.62561
354.632 60.57476
355.5963 61.48869
356.5605 62.27187
357.5247 63.88431
358.489 66.95037
359.4532 71.11601
360.4174 74.48494
361.3817 77.19614
362.3459 79.88125
363.3102 83.05228
364.2744 86.87035
365.2386 91.47385
366.2029 96.48166
367.1671 101.7763
368.1313 107.3431
369.0956 113.2319
370.0598 119.9788
371.024 127.675
371.9883 135.4227
372.9525 142.5318
373.9167 148.7498
374.881 155.3031
375.8452 164.5409
376.8094 175.3824
377.7737 186.6042
378.7379 197.2923
379.7021 207.2927
380.6664 216.8442
381.6306 226.6042
382.5948 236.4674
383.5591 246.6267
384.5233 257.369
385.4875 265.9122
386.4518 271.1231
387.416 274.2316
388.3802 275.6303
389.3445 275.6734
390.3087 275.216
391.2729 275.4977
392.2372 275.2946
393.2014 273.45
394.1656 269.4783
395.1299 263.9136
396.0941 258.7864
397.0583 254.2078
398.0226 249.0748
398.9868 242.5697
399.951 234.321
400.9153 225.2423
401.8795 214.6934
402.8437 204.1104
403.808 193.8334
404.7722 184.2255
405.7364 176.6362
406.7007 171.749
407.6649 167.786
408.6291 164.4616
409.5934 161.6175
410.5576 159.1116
411.5218 157.6797
412.4861 156.3075
413.4503 154.045
414.4145 150.5129
415.3788 145.5994
416.343 139.1645
417.3072 131.2155
418.2715 123.0505
419.2357 114.6953
420.1999 106.4861
421.1642 99.32116
422.1284 93.53453
423.0926 88.45358
424.0569 84.17599
425.0211 80.60775
425.9853 77.58581
426.9496 75.57758
427.9138 73.65797
428.878 70.98813
429.8423 67.82357
430.8065 64.78346
431.7707 62.75367
432.735 61.57294
433.6992 60.11456
434.6634 58.40377
435.6277 56.6095
436.5919 54.8987
437.5561 52.8617
438.5204 50.97971
439.4846 49.91842
440.4488 49.20666
441.4131 48.25907
442.3773 46.83754
443.3415 45.47235
444.3058 43.92999
445.27 42.44251
446.2342 41.28253
447.1985 40.674
448.1627 40.626
449.1269 41.18974
450.0912 41.69694
451.0554 41.44219
452.0196 40.06031
452.9839 37.87645
453.9481 36.68998
454.9123 36.4531
455.8766 36.71651
456.8408 37.34425
457.805 38.33874
458.7693 39.06925
459.7335 39.0314
460.6977 39.21321
461.662 39.94423
462.6262 41.12051
463.5904 42.17079
464.5547 42.95966
465.5189 43.71997
466.4831 44.4873
467.4474 45.28691
468.4116 46.10781
469.3758 46.75456
470.3401 47.24314
471.3043 48.11185
472.2685 49.48687
473.2328 51.09069
474.197 52.26908
475.1612 52.86762
476.1255 53.44692
477.0897 54.07528
478.0539 54.54868
479.0182 54.5607
479.9824 53.78676
480.9466 52.86458
481.9109 52.00019
482.8751 51.11932
483.8393 50.19149
484.8036 49.25373
485.7678 48.38375
486.732 47.54657
487.6963 46.67088
488.6605 45.62717
489.6247 44.33329
490.589 42.79223
491.5532 41.5757
492.5174 40.67279
493.4817 40.01044
494.4459 39.54703
495.4101 39.25655
496.3744 39.09043
497.3386 39.06241
498.3028 39.33416
499.2671 40.401
500.2313 41.91849
501.1955 42.60223
502.1598 40.53019
503.124 38.36272
504.0882 37.57732
505.0525 38.10905
506.0167 39.38214
506.9809 40.79909
507.9452 42.06554
508.9094 42.10916
509.8736 40.8296
510.8379 39.186
511.8021 38.48583
512.7663 39.2064
513.7305 39.54967
514.6948 39.33468
515.659 39.11729
516.6232 39.37613
517.5875 40.30534
518.5517 41.47305
519.5159 42.53006
520.4802 43.65716
521.4444 45.00031
522.4086 46.48958
523.3729 47.75608
524.3371 48.13542
525.3013 48.44972
526.2656 49.39303
527.2298 51.10996
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529.1583 56.24323
530.1225 59.85738
531.0867 62.8419
532.051 64.81319
533.0152 66.57385
533.9794 69.50935
534.9437 73.9107
535.9079 78.87639
536.8721 84.74859
537.8364 90.49062
538.8006 94.88846
539.7648 97.07676
540.7291 99.10593
541.6933 103.7204
542.6575 109.6868
543.6218 115.5683
544.586 120.427
545.5502 124.3544
546.5145 127.2181
547.4787 129.3623
548.4429 130.5004
549.4072 130.0981
550.3714 128.0469
551.3356 125.3877
552.2999 122.3362
553.2641 118.5931
554.2283 113.8175
555.1926 108.5362
556.1568 103.726
557.121 100.2819
558.0853 97.43565
559.0495 93.99332
560.0137 89.94357
560.978 85.66975
561.9422 81.68472
562.9064 78.11461
563.8707 74.6368
564.8349 71.37786
565.7991 68.56975
566.7634 66.24499
567.7276 64.21194
568.6918 62.14813
569.6561 60.26096
570.6203 58.3224
571.5845 56.41938
572.5488 54.60106
573.513 52.78162
574.4772 50.46994
575.4415 48.32129
576.4057 46.80117
577.3699 45.83364
578.3342 45.12027
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580.2626 43.13678
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582.1911 40.54742
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584.1196 39.12663
585.0838 39.42648
586.048 39.25879
587.0123 38.26074
587.9765 37.24288
588.9407 36.58118
589.905 36.35625
590.8692 36.42921
591.8334 36.8301
592.7977 37.2311
593.7619 37.46695
594.7261 37.53926
595.6904 37.53424
596.6546 37.53153
597.6188 37.50076
598.5831 37.59829
599.5473 37.92307
600.5115 38.36786
601.4758 38.72385
602.44 38.80258
603.4042 38.82495
604.3685 39.18622
605.3327 39.54922
606.2969 39.57311
607.2612 39.22357
608.2254 39.1638
609.1896 40.06968
610.1539 40.79607
611.1181 40.89065
612.0823 40.47457
613.0466 39.9334
614.0108 39.5408
614.975 39.33704
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616.9035 40.02584
617.8677 40.47296
618.832 40.45139
619.7962 39.87817
620.7604 39.914
621.7247 40.69928
622.6889 41.56845
623.6531 42.44674
624.6174 43.36395
625.5816 43.86443
626.5458 43.09954
627.5101 42.29067
628.4743 41.66003
629.4385 41.3306
630.4028 41.41892
631.367 42.11193
632.3312 43.20788
633.2955 44.23759
634.2597 45.00946
635.2239 45.29325
636.1882 45.04071
637.1524 44.57005
638.1166 45.43431
639.0809 47.74963
640.0451 49.54232
641.0093 49.88199
641.9736 49.05649
642.9378 48.59711
643.902 49.49811
644.8663 50.65747
645.8305 51.49119
646.7947 51.93945
647.759 52.13828
648.7232 52.27967
649.6874 52.6949
650.6517 53.88911
651.6159 55.45035
652.5801 56.54243
653.5444 56.65699
654.5086 56.05143
655.4728 56.53056
656.4371 58.40686
657.4013 60.01037
658.3655 61.24388
659.3298 62.13704
660.294 62.52341
661.2582 61.75566
662.2225 61.82248
663.1867 63.34939
664.1509 65.24488
665.1152 66.57669
666.0794 67.07652
667.0436 67.61686
668.0079 69.51331
668.9721 71.87335
669.9363 73.58529
670.9006 74.26806
671.8648 74.3868
672.829 75.19401
673.7933 77.27398
674.7575 79.20197
675.7217 80.8125
676.686 81.99073
677.6502 82.70375
678.6144 83.03622
679.5787 83.42921
680.5429 84.38099
681.5071 85.31024
682.4714 85.69082
683.4356 85.37179
684.3998 84.62841
685.3641 83.65569
686.3283 82.58576
687.2925 81.84064
688.2568 81.23928
689.221 80.15317
690.1852 77.90015
691.1495 74.50877
692.1137 71.19303
693.0779 68.08355
694.0422 65.14011
695.0064 62.05503
695.9706 58.71014
696.9349 55.65586
697.8991 53.36157
698.8633 51.11185
699.8276 48.88993
700.7918 46.82214
701.756 45.07203
702.7203 43.71027
703.6845 42.364
704.6487 40.33941
705.613 37.81905
706.5772 35.26831
707.5414 33.00406
708.5057 31.12235
709.4699 29.69651
710.4341 29.15484
711.3984 28.23214
712.3626 26.40727
713.3268 24.22726
714.2911 22.6232
715.2553 21.95108
716.2195 21.45577
717.1838 20.62411
718.148 19.86975
719.1122 19.71157
720.0765 20.08856
721.0407 20.07928
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