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###CBF: VERSION 1.1
# Template for Diamond MX beamlines phase 1 - replacing what we currently
# have in ADSC, Rayonix and DECTRIS image headers with a standard syntax
# and description.
#
# DECTRIS translation table follows...
#
@ Exposure_time _expt_
@ Exposure_period _expp_
@ Start_angle _omega_ 3.987
@ Angle_increment _d_omega_ 0.123
@ Timestamp _timestamp_
@ Count_cutoff _cutoff_
@ Compression_type _compress_
@ X_dimension _wide_
@ Y_dimension _high_
#
# These items will be pre-populated in the template so need not be included:
#
# Wavelength
# Detector_distance
# Beam_xy
# Alpha
# Kappa
# Phi
# Chi
# Oscillation_axis
# Pixel_size
# Detector
--- End of preamble
# This and all subsequent lines will appear in the header
_diffrn.id DLS_I03
_diffrn.crystal_id XTAL0001
# the following items will be fixed for the beamline
loop_
_diffrn_source.diffrn_id
_diffrn_source.source
_diffrn_source.type
DLS_I03 synchrotron 'Diamond Light Source Beamline I03'
loop_
_diffrn_radiation.diffrn_id
_diffrn_radiation.wavelength_id
_diffrn_radiation.monochromator
_diffrn_radiation.polarizn_source_ratio
_diffrn_radiation.polarizn_source_norm
_diffrn_radiation.div_x_source
_diffrn_radiation.div_y_source
_diffrn_radiation.div_x_y_source
DLS_I03 WAVELENGTH1 'Si 111' 0.8 0.0 0.08 0.01 0.00
# category DIFFRN_DETECTOR
loop_
_diffrn_detector.diffrn_id
_diffrn_detector.id
_diffrn_detector.type
_diffrn_detector.number_of_axes
DLS_I03 ADSC_I03 'ADSC Quantum 315' 3
loop_
_diffrn_detector_axis.detector_id
_diffrn_detector_axis.axis_id
ADSC_I03 DETECTOR_X
ADSC_I03 DETECTOR_Y
ADSC_I03 DETECTOR_Z
loop_
_diffrn_detector_element.id
_diffrn_detector_element.detector_id
ELEMENT1 ADSC_I03
loop_
_diffrn_data_frame.id
_diffrn_data_frame.detector_element_id
_diffrn_data_frame.array_id
_diffrn_data_frame.binary_id
FRAME1 ELEMENT1 ARRAY1 1
loop_
_diffrn_scan.id
_diffrn_scan.frame_id_start
_diffrn_scan.frame_id_end
_diffrn_scan.frames
SCAN1 FRAME1 FRAME1 1
# at the moment we have only a single axis system in place - this will change
# to a kappa at some point for I04 -> number_of_axes = 3
# GONIOMETER GONIOMETER_PHI
# GONIOMETER GONIOMETER_KAPPA
loop_
_diffrn_measurement.diffrn_id
_diffrn_measurement.id
_diffrn_measurement.number_of_axes
_diffrn_measurement.method
DLS_I03 GONIOMETER 1 rotation
loop_
_diffrn_measurement_axis.measurement_id
_diffrn_measurement_axis.axis_id
GONIOMETER GONIOMETER_OMEGA
# these items will be written by GDA on a scan-by-scan basis
loop_
_diffrn_radiation_wavelength.id
_diffrn_radiation_wavelength.wavelength
_diffrn_radiation_wavelength.wt
WAVELENGTH1 0.97930 1.0
# these values should probably be updated from the results of postrefinement
loop_
_diffrn_scan_axis.scan_id
_diffrn_scan_axis.axis_id
_diffrn_scan_axis.angle_start
_diffrn_scan_axis.angle_range
_diffrn_scan_axis.angle_increment
_diffrn_scan_axis.displacement_start
_diffrn_scan_axis.displacement_range
_diffrn_scan_axis.displacement_increment
SCAN1 GONIOMETER_OMEGA _omega_ 1.0 _d_omega_ 0.0 0.0 0.0
SCAN1 DETECTOR_Z 0.0 0.0 0.0 -240.0 0.0 0.0
SCAN1 DETECTOR_Y 0.0 0.0 0.0 0.6 0.0 0.0
SCAN1 DETECTOR_X 0.0 0.0 0.0 -0.5 0.0 0.0
loop_
_diffrn_scan_frame.frame_id
_diffrn_scan_frame.frame_number
_diffrn_scan_frame.integration_time
_diffrn_scan_frame.exposure_time
_diffrn_scan_frame.scan_id
_diffrn_scan_frame.date
FRAME1 1 _expt_ _expp_ SCAN1 _timestamp_
loop_
_diffrn_scan_frame_axis.frame_id
_diffrn_scan_frame_axis.axis_id
_diffrn_scan_frame_axis.angle
_diffrn_scan_frame_axis.displacement
FRAME1 GONIOMETER_OMEGA 12.0 0.0
FRAME1 DETECTOR_Z 0.0 -240.0
FRAME1 DETECTOR_Y 0.0 0.6
FRAME1 DETECTOR_X 0.0 -0.5
# this could also contain postrefined results
loop_
_axis.id
_axis.type
_axis.equipment
_axis.depends_on
_axis.vector[1] _axis.vector[2] _axis.vector[3]
_axis.offset[1] _axis.offset[2] _axis.offset[3]
GONIOMETER_OMEGA rotation goniometer . 1 0 0 . . .
SOURCE general source . 0 0 1 . . .
GRAVITY general gravity . 0 -1 0 . . .
DETECTOR_Z translation detector . 0 0 1 0 0 0
DETECTOR_Y translation detector DETECTOR_Z 0 1 0 0 0 0
DETECTOR_X translation detector DETECTOR_Y 1 0 0 0 0 0
ELEMENT_X translation detector DETECTOR_X 1 0 0 157.2 157.2 0
ELEMENT_Y translation detector ELEMENT_X 0 1 0 0 0 0
loop_
_array_structure_list.array_id
_array_structure_list.index
_array_structure_list.dimension
_array_structure_list.precedence
_array_structure_list.direction
_array_structure_list.axis_set_id
ARRAY1 1 _wide_ 1 increasing ELEMENT_X
ARRAY1 2 _high_ 2 increasing ELEMENT_Y
loop_
_array_structure_list_axis.axis_set_id
_array_structure_list_axis.axis_id
_array_structure_list_axis.displacement
_array_structure_list_axis.displacement_increment
ELEMENT_X ELEMENT_X 0.0512 0.1024
ELEMENT_Y ELEMENT_Y 0.0512 0.1024
loop_
_array_element_size.array_id
_array_element_size.index
_array_element_size.size
ARRAY1 1 102.4e-6
ARRAY1 2 102.4e-6
loop_
_array_intensities.array_id
_array_intensities.binary_id
_array_intensities.linearity
_array_intensities.gain
_array_intensities.gain_esd
_array_intensities.overload
_array_intensities.undefined_value
ARRAY1 1 linear 0.5 0.2 _cutoff_ 0
loop_
_array_structure.id
_array_structure.encoding_type
_array_structure.compression_type
_array_structure.byte_order
ARRAY1 "signed 32-bit integer" _compress_ little_endian
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