#------------------------------------------------------------------------------
#$Date: 2017-10-05 18:15:36 +0300 (Thu, 05 Oct 2017) $
#$Revision: 219 $
#$URL: svn://172.16.1.111/rod/cif/3/50/00/3500049.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_3500049
loop_
_publ_author_name
'El Mendili, Y'
_publ_section_title
;
 Raman spectrum of commercial FeSO4
;
_journal_name_full               'Personal communication to ROD'
_journal_year                    2017
_chemical_compound_source        'commercial Aldrich 99%'
_chemical_formula_structural     'Fe O4 S'
_chemical_formula_sum            'Fe O4 S'
_chemical_name_mineral           'Iron(II) sulfate'
_chemical_name_systematic        'Iron(II) sulfate'
_space_group_IT_number           62
_symmetry_cell_setting           orthorhombic
_symmetry_space_group_name_Hall  '-P 2ac 2n'
_symmetry_space_group_name_H-M   'P n m a'
_cell_angle_alpha                90.00
_cell_angle_beta                 90.00
_cell_angle_gamma                90.00
_cell_formula_units_Z            4
_cell_length_a                   8.7042(8)
_cell_length_b                   6.8013(5)
_cell_length_c                   4.7868(5)
_raman_determination_method      experimental
_[local]_chemical_compound_color green
_[local]_chemical_compound_state Solid
_raman_measurement_device.location ENSICAEN
_raman_measurement_device.company 'Thermo Scientific'
_raman_measurement_device.name   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 30
_raman_measurement.range_min     99.34898
_raman_measurement.range_max     3500.199
_rod_data_source.file            FeSO4.rod
_rod_data_source.block           1000005
_rod_database.code               3500049
_solsa_sample.id                 CN-AA00-0038
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 2216658 COD http://www.crystallography.net/cod/2216658.html
;
no XRD analysis data.
;
loop_
_raman_spectrum.raman_shift
_raman_spectrum.intensity
9.934898e+001 -1.702347e+001
1.003132e+002 -1.796196e+001
1.012774e+002 -1.795477e+001
1.022417e+002 -1.701084e+001
1.032059e+002 -1.512767e+001
1.041701e+002 -1.232271e+001
1.051344e+002 -7.993783e+000
1.060986e+002 -2.532048e+000
1.070628e+002 4.694320e+000
1.080271e+002 1.305052e+001
1.089913e+002 2.016888e+001
1.099555e+002 2.577209e+001
1.109198e+002 2.953870e+001
1.118840e+002 3.083490e+001
1.128482e+002 2.964014e+001
1.138125e+002 2.733511e+001
1.147767e+002 2.512095e+001
1.157409e+002 2.257959e+001
1.167052e+002 1.929824e+001
1.176694e+002 1.499741e+001
1.186336e+002 1.013021e+001
1.195979e+002 6.242920e+000
1.205621e+002 3.074740e+000
1.215263e+002 1.555176e-001
1.224906e+002 -3.181738e+000
1.234548e+002 -7.250765e+000
1.244190e+002 -1.047415e+001
1.253833e+002 -1.267492e+001
1.263475e+002 -1.396976e+001
1.273117e+002 -1.483770e+001
1.282760e+002 -1.494783e+001
1.292402e+002 -1.525684e+001
1.302044e+002 -1.625487e+001
1.311687e+002 -1.794224e+001
1.321329e+002 -1.923717e+001
1.330971e+002 -1.869652e+001
1.340614e+002 -1.776133e+001
1.350256e+002 -1.710010e+001
1.359898e+002 -1.709082e+001
1.369541e+002 -1.724289e+001
1.379183e+002 -1.680378e+001
1.388825e+002 -1.610395e+001
1.398468e+002 -1.553651e+001
1.408110e+002 -1.553940e+001
1.417752e+002 -1.652576e+001
1.427395e+002 -1.664930e+001
1.437037e+002 -1.545010e+001
1.446679e+002 -1.329053e+001
1.456322e+002 -1.109621e+001
1.465964e+002 -9.363753e+000
1.475606e+002 -7.283984e+000
1.485249e+002 -4.877246e+000
1.494891e+002 -2.140381e+000
1.504533e+002 1.006201e+000
1.514176e+002 5.306120e+000
1.523818e+002 1.001317e+001
1.533460e+002 1.489722e+001
1.543103e+002 1.977928e+001
1.552745e+002 2.437664e+001
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1.572030e+002 3.238546e+001
1.581672e+002 3.550269e+001
1.591314e+002 3.773387e+001
1.600957e+002 3.876948e+001
1.610599e+002 3.780343e+001
1.620241e+002 3.512765e+001
1.629884e+002 3.109517e+001
1.639526e+002 2.598208e+001
1.649168e+002 1.863465e+001
1.658811e+002 1.221455e+001
1.668453e+002 6.543945e+000
1.678095e+002 1.583822e+000
1.687738e+002 -2.719320e+000
1.697380e+002 -6.025163e+000
1.707022e+002 -8.631917e+000
1.716665e+002 -1.050103e+001
1.726307e+002 -1.182393e+001
1.735949e+002 -1.300954e+001
1.745592e+002 -1.484665e+001
1.755234e+002 -1.659652e+001
1.764876e+002 -1.753605e+001
1.774519e+002 -1.741960e+001
1.784161e+002 -1.642106e+001
1.793803e+002 -1.590674e+001
1.803446e+002 -1.583729e+001
1.813088e+002 -1.588989e+001
1.822730e+002 -1.602056e+001
1.832373e+002 -1.655617e+001
1.842015e+002 -1.589059e+001
1.851657e+002 -1.329463e+001
1.861300e+002 -1.015160e+001
1.870942e+002 -7.634831e+000
1.880584e+002 -6.547071e+000
1.890227e+002 -5.364762e+000
1.899869e+002 -3.506136e+000
1.909511e+002 -1.334196e+000
1.919154e+002 6.954427e-001
1.928796e+002 1.967204e+000
1.938438e+002 2.838769e+000
1.948081e+002 4.016813e+000
1.957723e+002 5.595947e+000
1.967365e+002 7.451546e+000
1.977008e+002 9.035384e+000
1.986650e+002 1.036608e+001
1.996292e+002 1.268454e+001
2.005935e+002 1.616292e+001
2.015577e+002 2.078410e+001
2.025219e+002 2.679490e+001
2.034862e+002 3.513158e+001
2.044504e+002 4.436488e+001
2.054146e+002 5.371886e+001
2.063789e+002 6.281502e+001
2.073431e+002 7.256316e+001
2.083073e+002 8.219118e+001
2.092715e+002 9.347790e+001
2.102358e+002 1.081759e+002
2.112000e+002 1.272918e+002
2.121642e+002 1.490076e+002
2.131285e+002 1.716631e+002
2.140927e+002 1.934616e+002
2.150569e+002 2.128195e+002
2.160212e+002 2.283920e+002
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2.179496e+002 2.406434e+002
2.189139e+002 2.342145e+002
2.198781e+002 2.219520e+002
2.208423e+002 2.072005e+002
2.218066e+002 1.882558e+002
2.227708e+002 1.681849e+002
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2.246993e+002 1.224826e+002
2.256635e+002 1.026972e+002
2.266277e+002 8.902197e+001
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2.343416e+002 2.724858e+001
2.353058e+002 2.164063e+001
2.362701e+002 1.744455e+001
2.372343e+002 1.430282e+001
2.381985e+002 1.162257e+001
2.391628e+002 9.193376e+000
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2.439839e+002 1.486019e+000
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2.507336e+002 -9.726400e-001
2.516978e+002 6.870931e-001
2.526620e+002 3.065983e+000
2.536263e+002 5.869629e+000
2.545905e+002 8.845703e+000
2.555547e+002 1.200448e+001
2.565190e+002 1.539761e+001
2.574832e+002 1.890308e+001
2.584474e+002 2.330991e+001
2.594117e+002 2.945739e+001
2.603759e+002 3.627321e+001
2.613401e+002 4.726053e+001
2.623044e+002 6.168021e+001
2.632686e+002 8.008587e+001
2.642328e+002 1.034519e+002
2.651971e+002 1.361280e+002
2.661613e+002 1.700663e+002
2.671255e+002 2.068623e+002
2.680898e+002 2.421096e+002
2.690540e+002 2.702063e+002
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2.709825e+002 2.869833e+002
2.719467e+002 2.760119e+002
2.729109e+002 2.533836e+002
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2.748394e+002 1.928310e+002
2.758036e+002 1.628766e+002
2.767679e+002 1.347948e+002
2.777321e+002 1.084286e+002
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2.950883e+002 8.009945e+000
2.960526e+002 7.497461e+000
2.970168e+002 7.067545e+000
2.979810e+002 7.044857e+000
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3.008737e+002 7.224317e+000
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3.047307e+002 -4.155762e-001
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3.201584e+002 -1.328548e+001
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3.240153e+002 -2.072601e+001
3.249795e+002 -1.976794e+001
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3.269080e+002 -1.910156e+001
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3.394430e+002 -1.840457e+001
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3.413715e+002 -1.801100e+001
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