#\#CIF_2.0
#------------------------------------------------------------------------------
#$Date: 2018-06-07 11:29:14 +0300 (Thu, 07 Jun 2018) $
#$Revision: 1137 $
#$URL: svn://172.16.1.111/rod/cif/1/00/05/1000560.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_1000560
loop_
_publ_author_name
'Merlino, S.'
'Orlandi, P.'
_publ_section_title
;
 Carraraite and zaccagnaite, two new minerals from the Carrara marble
 quarries: their chemical compositions, physical properties and structural
 features
;
_journal_name_full               'American Mineralogist'
_journal_page_first              1293
_journal_page_last               1301
_journal_volume                  86
_journal_year                    2001
_chemical_compound_source        R130410
_chemical_formula_sum            'C H2 Al0.333 O5 Zn0.667'
_chemical_name_mineral           Zaccagnaite
_space_group_IT_number           194
_symmetry_space_group_name_Hall  '-P 6c 2c'
_symmetry_space_group_name_H-M   'P 63/m m c'
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                120
_cell_length_a                   3.0725
_cell_length_b                   3.0725
_cell_length_c                   15.114
_cell_volume                     123.565
_exptl_crystal_density_diffrn    3.941
_cod_original_formula_sum        '(Al.333 Zn.667) O5 C H2'
_cod_database_code               9002646
_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            R130410.rod
_rod_data_source.block           3500000
_rod_database.code               1000560
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 9002646 COD http://www.crystallography.net/cod/9002646.html
;
XRD analysis data was done.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
94.09229 0.0000000E+00
94.57440 9.479736
95.05651 16.28369
95.53863 17.05432
96.02074 16.22290
96.50286 11.36316
96.98498 6.010986
97.46709 0.3394780
97.94921 0.7730710
98.43133 8.776855
98.91344 19.37695
99.39556 30.99951
99.87768 43.32031
100.3598 57.02759
100.8419 74.93518
101.3240 96.51379
101.8061 119.1774
102.2883 142.2505
102.7704 158.5199
103.2525 166.1401
103.7346 166.0883
104.2167 160.2052
104.6988 147.6307
105.1810 130.8342
105.6631 112.3382
106.1452 92.63055
106.6273 72.52429
107.1094 54.03284
107.5915 37.09491
108.0737 22.88727
108.5558 11.49805
109.0379 3.345154
109.5200 1.828247
110.0021 4.107971
110.4842 3.355530
110.9664 2.106628
111.4485 0.5065920
111.9306 1.569885
112.4127 4.571838
112.8948 8.401917
113.3769 12.59454
113.8591 16.48254
114.3412 20.36334
114.8233 23.21423
115.3054 24.28235
115.7875 24.91846
116.2696 26.62518
116.7517 30.00281
117.2339 34.10883
117.7160 36.25629
118.1981 35.55634
118.6802 35.14124
119.1623 36.51910
119.6444 38.91394
120.1266 40.09735
120.6087 38.69623
121.0908 35.64655
121.5729 33.20923
122.0550 31.98065
122.5371 30.73254
123.0193 28.57367
123.5014 23.90527
123.9835 19.94226
124.4656 18.08533
124.9477 17.25403
125.4298 17.07355
125.9120 16.67572
126.3941 16.50653
126.8762 17.41742
127.3583 20.05267
127.8404 23.08606
128.3225 25.96332
128.8047 28.87848
129.2868 32.15417
129.7689 35.94495
130.2510 40.23145
130.7331 44.83661
131.2152 50.45331
131.6974 55.69397
132.1795 59.89172
132.6616 63.42908
133.1437 67.20715
133.6258 72.20850
134.1079 78.83325
134.5901 84.12878
135.0722 87.60559
135.5543 90.45081
136.0364 93.50140
136.5185 96.77551
137.0006 99.54352
137.4828 101.0245
137.9649 101.0791
138.4470 99.79999
138.9291 97.16302
139.4112 93.20062
139.8933 87.64008
140.3755 80.23560
140.8576 72.07288
141.3397 64.43396
141.8218 57.26935
142.3039 50.42572
142.7860 43.61340
143.2681 37.02551
143.7503 31.32104
144.2324 26.80420
144.7145 23.17157
145.1966 20.08124
145.6787 17.52905
146.1608 15.18732
146.6430 12.60199
147.1251 9.662292
147.6072 7.493347
148.0893 7.006775
148.5714 6.921082
149.0535 6.885132
149.5357 6.760193
150.0178 6.052307
150.4999 3.832764
150.9820 0.9901120
151.4641 5.019470
151.9462 5.228821
152.4284 4.975403
152.9105 4.954407
153.3926 5.399353
153.8747 6.067871
154.3568 6.295654
154.8389 5.448303
155.3211 4.838562
155.8032 4.896301
156.2853 4.989685
156.7674 4.378357
157.2495 2.674133
157.7316 0.1032710
158.2138 2.358459
158.6959 4.801270
159.1780 6.982910
159.6601 8.782227
160.1422 10.24884
160.6243 11.48596
161.1065 12.49396
161.5886 13.38995
162.0707 14.61865
162.5528 16.27411
163.0349 18.14130
163.5170 19.99524
163.9991 21.87689
164.4813 24.15051
164.9634 27.30957
165.4455 31.00574
165.9276 34.32019
166.4097 36.88007
166.8918 39.19122
167.3740 41.71149
167.8561 44.55481
168.3382 47.83069
168.8203 52.02942
169.3024 56.56763
169.7845 60.67657
170.2667 63.83777
170.7488 66.46161
171.2309 69.50653
171.7130 73.11188
172.1951 76.87598
172.6772 80.81116
173.1594 84.75079
173.6415 88.45087
174.1236 91.68085
174.6057 94.58527
175.0878 97.95990
175.5699 102.7222
176.0521 106.8646
176.5342 109.5060
177.0163 111.1923
177.4984 112.8621
177.9805 115.1976
178.4626 118.1964
178.9448 121.1246
179.4269 124.2021
179.9090 127.0110
180.3911 129.4764
180.8732 131.5399
181.3553 133.0338
181.8375 133.7223
182.3196 133.4364
182.8017 134.3180
183.2838 136.8334
183.7659 139.8033
184.2480 142.8196
184.7301 145.8069
185.2123 148.7068
185.6944 151.3434
186.1765 153.6353
186.6586 156.7812
187.1407 161.2903
187.6228 166.2265
188.1050 170.7920
188.5871 174.9119
189.0692 179.3072
189.5513 184.8292
190.0334 191.4380
190.5155 197.8420
190.9977 203.5652
191.4798 209.1597
191.9619 215.2991
192.4440 222.1132
192.9261 229.2091
193.4082 236.2607
193.8904 243.3092
194.3725 250.4792
194.8546 257.7901
195.3367 265.2703
195.8188 272.8371
196.3009 280.1557
196.7831 288.3516
197.2652 298.4004
197.7473 309.9086
198.2294 321.8848
198.7115 333.7959
199.1936 345.8073
199.6758 358.4331
200.1579 371.5266
200.6400 385.6825
201.1221 401.1301
201.6042 417.6719
202.0863 434.6700
202.5685 451.7925
203.0506 469.0532
203.5327 486.1960
204.0148 502.3997
204.4969 519.3509
204.9790 538.8542
205.4612 559.6554
205.9433 579.0430
206.4254 594.5317
206.9075 605.9548
207.3896 616.7845
207.8717 629.1799
208.3539 638.8675
208.8360 644.5977
209.3181 646.1353
209.8002 643.9810
210.2823 638.3957
210.7644 629.4500
211.2466 616.4344
211.7287 597.9330
212.2108 577.2260
212.6929 554.9199
213.1750 531.4436
213.6571 507.0285
214.1393 481.7786
214.6214 455.3799
215.1035 430.7593
215.5856 407.8822
216.0677 386.2798
216.5498 365.2382
217.0320 345.0696
217.5141 326.7385
217.9962 311.4067
218.4783 299.4890
218.9604 287.8849
219.4425 276.3038
219.9247 265.1688
220.4068 254.5790
220.8889 244.5964
221.3710 235.4683
221.8531 227.5155
222.3352 220.8712
222.8174 214.3525
223.2995 207.2449
223.7816 200.7584
224.2637 196.2121
224.7458 193.5653
225.2279 191.1407
225.7100 187.4155
226.1922 182.6420
226.6743 178.7613
227.1564 176.2781
227.6385 174.5016
228.1206 173.0389
228.6027 171.9190
229.0849 170.7177
229.5670 168.8343
230.0491 166.5781
230.5312 164.9130
231.0133 164.3939
231.4954 164.3816
231.9776 164.2026
232.4597 163.8374
232.9418 163.3222
233.4239 162.8062
233.9060 162.1322
234.3881 160.9419
234.8703 158.8006
235.3524 156.3646
235.8345 154.5129
236.3166 153.3070
236.7987 152.3597
237.2808 151.6911
237.7630 151.1343
238.2451 150.4317
238.7272 149.4069
239.2093 148.2758
239.6914 147.4387
240.1735 146.9855
240.6557 146.5549
241.1378 146.4500
241.6199 146.1401
242.1020 144.8924
242.5841 142.2520
243.0662 139.0285
243.5484 136.6806
244.0305 135.5548
244.5126 134.5262
244.9947 133.9783
245.4768 132.9911
245.9589 130.5068
246.4410 126.1048
246.9232 120.9020
247.4053 116.8456
247.8874 114.5916
248.3695 111.9576
248.8516 108.2594
249.3337 104.2619
249.8159 100.6590
250.2980 97.63901
250.7801 94.70776
251.2622 90.90149
251.7443 85.68701
252.2264 80.84177
252.7086 76.39725
253.1907 72.39371
253.6728 69.05765
254.1549 66.37177
254.6370 63.79572
255.1191 60.33005
255.6013 55.07352
256.0834 50.96365
256.5655 48.96136
257.0476 47.25885
257.5297 44.37863
258.0118 40.20389
258.4940 35.95349
258.9761 33.41672
259.4582 33.71503
259.9403 32.89383
260.4224 30.25394
260.9045 27.27255
261.3867 24.69958
261.8688 22.68561
262.3509 21.14841
262.8330 20.05435
263.3151 19.66037
263.7972 18.74316
264.2794 16.86078
264.7615 14.93445
265.2436 13.38321
265.7257 12.27710
266.2078 11.56381
266.6899 11.25992
267.1721 11.49695
267.6542 11.29056
268.1363 10.33319
268.6184 9.312103
269.1005 8.501129
269.5826 7.925140
270.0648 7.553406
270.5469 7.406525
271.0290 7.506134
271.5111 7.224884
271.9932 6.322113
272.4753 5.361694
272.9575 4.427582
273.4396 3.613953
273.9217 3.145599
274.4038 3.219147
274.8859 3.778992
275.3680 4.165802
275.8501 4.469696
276.3322 4.548615
276.8144 4.160004
277.2965 3.502502
277.7786 3.050507
278.2607 3.102966
278.7428 3.495667
279.2249 3.495087
279.7071 2.900696
280.1892 2.261810
280.6713 1.520203
281.1534 0.8079220
281.6355 0.4697880
282.1176 0.7192380
282.5998 1.287689
283.0819 1.474731
283.5640 1.111145
284.0461 0.7507020
284.5282 0.6145940
285.0103 0.5260010
285.4925 0.1478270
285.9746 0.6651610
286.4567 1.583221
286.9388 1.999115
287.4209 1.718048
287.9030 1.633911
288.3852 2.058350
288.8673 2.680450
289.3494 3.113586
289.8315 3.268372
290.3136 3.311401
290.7957 3.468323
291.2779 3.770142
291.7600 3.921143
292.2421 3.823090
292.7242 3.602051
293.2063 3.311981
293.6884 2.967255
294.1706 2.742065
294.6527 2.876099
295.1348 3.367493
295.6169 3.580231
296.0990 3.286469
296.5811 2.854614
297.0633 2.532684
297.5454 2.333801
298.0275 2.247345
298.5096 2.380676
298.9917 2.614166
299.4738 2.350189
299.9560 0.8923030
300.4381 0.4226380
300.9202 0.6318970
301.4023 5.5114999E-02
301.8844 0.6536870
302.3665 0.6507260
302.8487 0.2052610
303.3308 0.1558530
303.8129 0.3617860
304.2950 0.6031490
304.7771 0.8446660
305.2592 1.176819
305.7414 1.946716
306.2235 3.445587
306.7056 5.142303
307.1877 5.874817
307.6698 5.416718
308.1519 5.143250
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309.1162 6.867615
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310.0804 6.997314
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312.0089 7.129456
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312.9731 9.526703
313.4552 9.757233
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314.4195 7.772675
314.9016 7.319458
315.3837 7.477966
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316.3479 7.843567
316.8300 7.979279
317.3121 7.836548
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318.2764 7.331482
318.7585 8.020233
319.2406 9.224304
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323.0975 5.509003
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325.5081 5.538605
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336.1147 1.897949
336.5968 1.168701
337.0789 0.4630740
337.5610 2.1667000E-02
338.0432 0.2202150
338.5253 0.1346440
339.0074 1.276306
339.4895 2.791962
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340.4537 2.717499
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390.1117 21.54788
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392.5223 17.59488
393.0044 16.32275
393.4865 14.86472
393.9687 13.05798
394.4508 11.11417
394.9329 9.384277
395.4150 7.896881
395.8971 6.566284
396.3792 5.345337
396.8614 4.240875
397.3435 3.198975
397.8256 1.979126
398.3077 1.001617
398.7898 0.8114010
399.2719 1.168243
399.7540 1.088470
400.2361 7.0037998E-02
400.7183 1.751007
401.2004 2.227386
401.6825 0.6800840
402.1646 0.4297790
402.6467 5.6090999E-02
403.1288 0.6901860
403.6110 0.2936400
404.0931 1.520813
404.5752 3.510101
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406.9858 4.289459
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407.9500 7.748199
408.4321 9.554138
408.9142 11.07877
409.3964 12.37256
409.8785 13.69373
410.3606 15.03659
410.8427 16.41208
411.3248 17.59045
411.8069 18.92123
412.2891 20.89581
412.7712 23.57199
413.2533 26.37540
413.7354 28.45779
414.2175 29.54672
414.6996 31.04269
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417.1102 42.93112
417.5923 45.63571
418.0745 48.45129
418.5566 51.36270
419.0387 54.55591
419.5208 57.38956
420.0029 59.55511
420.4850 61.34595
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