PyPowder 0.0.0a2__tar.gz → 0.0.0a4__tar.gz
This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.
- pypowder-0.0.0a4/.gitattributes +2 -0
- pypowder-0.0.0a4/.github/workflows/python-publish.yml +70 -0
- pypowder-0.0.0a4/.gitignore +160 -0
- {pypowder-0.0.0a2 → pypowder-0.0.0a4}/PKG-INFO +4 -4
- pypowder-0.0.0a4/RunConversion.bat +3 -0
- {pypowder-0.0.0a2 → pypowder-0.0.0a4}/pyproject.toml +8 -4
- pypowder-0.0.0a4/requirements.txt +4 -0
- pypowder-0.0.0a4/src/PyPOW/__version__.py +24 -0
- {pypowder-0.0.0a2 → pypowder-0.0.0a4}/src/PyPowder.egg-info/PKG-INFO +4 -4
- pypowder-0.0.0a4/src/PyPowder.egg-info/SOURCES.txt +25 -0
- pypowder-0.0.0a4/src/PyPowder.egg-info/scm_file_list.json +21 -0
- pypowder-0.0.0a4/src/PyPowder.egg-info/scm_version.json +8 -0
- pypowder-0.0.0a4/tests/ASG1_1.XRDML +61 -0
- pypowder-0.0.0a4/tests/ASG1_1.csv +5000 -0
- pypowder-0.0.0a4/tests/ASG1_1.gsas +502 -0
- pypowder-0.0.0a4/tests/ASG1_1.xy +4999 -0
- pypowder-0.0.0a4/tests/working_example.py +59 -0
- pypowder-0.0.0a2/src/PyPowder.egg-info/SOURCES.txt +0 -12
- {pypowder-0.0.0a2 → pypowder-0.0.0a4}/LICENCE +0 -0
- {pypowder-0.0.0a2 → pypowder-0.0.0a4}/README.md +0 -0
- {pypowder-0.0.0a2 → pypowder-0.0.0a4}/setup.cfg +0 -0
- {pypowder-0.0.0a2 → pypowder-0.0.0a4}/src/PyPOW/__init__.py +0 -0
- {pypowder-0.0.0a2 → pypowder-0.0.0a4}/src/PyPOW/import_module.py +0 -0
- {pypowder-0.0.0a2 → pypowder-0.0.0a4}/src/PyPOW/lab.py +0 -0
- {pypowder-0.0.0a2 → pypowder-0.0.0a4}/src/PyPOW/run_XY_conversion.py +0 -0
- {pypowder-0.0.0a2 → pypowder-0.0.0a4}/src/PyPowder.egg-info/dependency_links.txt +0 -0
- {pypowder-0.0.0a2 → pypowder-0.0.0a4}/src/PyPowder.egg-info/requires.txt +0 -0
- {pypowder-0.0.0a2 → pypowder-0.0.0a4}/src/PyPowder.egg-info/top_level.txt +0 -0
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# This workflow will upload a Python Package to PyPI when a release is created
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name: Upload Python Package
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permissions:
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Metadata-Version: 2.4
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Name: PyPowder
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Version: 0.0.
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Version: 0.0.0a4
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Summary: Attempt at constructing a set of tools to convert XRDML files to a more usable format.
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Author-email: Diogo Almeida <dafda1@st-andrews.ac.uk>
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Author-email: Diogo Almeida <dafda1@st-andrews.ac.uk>, Max Pelly <mp250@st-andrews.ac.uk>
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License-Expression: GPL-3.0-or-later
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Project-URL: Homepage, https://github.com/MaxPelly/PyPOW
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Project-URL: Issues, https://github.com/MaxPelly/PyPOW/issues
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Classifier: Programming Language :: Python :: 3
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Classifier: Operating System :: OS Independent
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name = "PyPowder"
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authors = [
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{ name="Diogo Almeida", email="dafda1@st-andrews.ac.uk" },
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{ name="Max Pelly", email="mp250@st-andrews.ac.uk" },
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description = "Attempt at constructing a set of tools to convert XRDML files to a more usable format."
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readme = "README.md"
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version_file = "src/PyPOW/__version__.py"
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Version: 0.0.
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Version: 0.0.0a4
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Summary: Attempt at constructing a set of tools to convert XRDML files to a more usable format.
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Author-email: Diogo Almeida <dafda1@st-andrews.ac.uk>
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Author-email: Diogo Almeida <dafda1@st-andrews.ac.uk>, Max Pelly <mp250@st-andrews.ac.uk>
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License-Expression: GPL-3.0-or-later
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Project-URL: Homepage, https://github.com/
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Project-URL: Issues, https://github.com/
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Project-URL: Homepage, https://github.com/MaxPelly/PyPOW
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Project-URL: Issues, https://github.com/MaxPelly/PyPOW/issues
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Classifier: Programming Language :: Python :: 3
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Classifier: Operating System :: OS Independent
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Requires-Python: >=3.9
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.gitattributes
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.gitignore
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LICENCE
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README.md
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RunConversion.bat
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pyproject.toml
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requirements.txt
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.github/workflows/python-publish.yml
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src/PyPOW/__init__.py
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src/PyPOW/__version__.py
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src/PyPOW/import_module.py
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src/PyPOW/lab.py
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src/PyPOW/run_XY_conversion.py
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src/PyPowder.egg-info/PKG-INFO
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src/PyPowder.egg-info/SOURCES.txt
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src/PyPowder.egg-info/dependency_links.txt
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src/PyPowder.egg-info/requires.txt
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src/PyPowder.egg-info/scm_file_list.json
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src/PyPowder.egg-info/scm_version.json
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src/PyPowder.egg-info/top_level.txt
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tests/ASG1_1.XRDML
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tests/ASG1_1.csv
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tests/ASG1_1.gsas
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tests/ASG1_1.xy
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tests/working_example.py
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{
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"files": [
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"README.md",
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"LICENCE",
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"pyproject.toml",
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"RunConversion.bat",
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"requirements.txt",
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".gitattributes",
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".gitignore",
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"src/PyPOW/lab.py",
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"src/PyPOW/__init__.py",
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"src/PyPOW/import_module.py",
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"src/PyPOW/run_XY_conversion.py",
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"tests/ASG1_1.csv",
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"tests/ASG1_1.XRDML",
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"tests/ASG1_1.gsas",
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"tests/working_example.py",
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"tests/ASG1_1.xy",
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".github/workflows/python-publish.yml"
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]
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}
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<?xml version="1.0" encoding="UTF-8"?>
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<xrdMeasurements xmlns="http://www.xrdml.com/XRDMeasurement/1.5" xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xsi:schemaLocation="http://www.xrdml.com/XRDMeasurement/1.5 http://www.xrdml.com/XRDMeasurement/1.5/XRDMeasurement.xsd" status="Completed">
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<comment>
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<entry>Configuration=Reflection/Transmission, Owner=paul, Creation date=20/02/2013 12:06:42</entry>
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<entry>Goniometer=Omega/2Theta; Minimum step size 2Theta:0.0001; Minimum step size Omega:0.0001</entry>
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<entry>Sample stage=Reflection-transmission spinner; Minimum step size Phi:0.1</entry>
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<entry>Diffractometer system=EMPYREAN</entry>
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<entry>Measurement program=C:\PANalytical\Data Collector\Programs\John 5-90 1hr.xrdmp, Identifier={03C9B423-87C1-47B7-87E4-6B1805CFB0B6}</entry>
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<entry>Fine Calibration Offset for 2Theta = -0.0467 deg</entry>
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<entry>Batch program=C:\PANalytical\Data Collector\Programs\091024.xrdmp, Identifier={3C4B32C6-FFE4-4DFD-8179-9923AADEAB95}</entry>
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<entry/>
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</comment>
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<xrdMeasurement measurementType="Scan" status="Completed" sampleMode="Reflection">
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<usedWavelength intended="K-Alpha 1">
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<kAlpha1 unit="Angstrom">1.540598</kAlpha1>
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<kAlpha2 unit="Angstrom">1.544426</kAlpha2>
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<kBeta unit="Angstrom">1.392250</kBeta>
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<ratioKAlpha2KAlpha1>0.000000</ratioKAlpha2KAlpha1>
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</usedWavelength>
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<incidentBeamPath>
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<radius unit="mm">240.000</radius>
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<xRayTube>
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<tension unit="kV">45</tension>
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<current unit="mA">40</current>
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<anodeMaterial>Cu</anodeMaterial>
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</xRayTube>
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<divergenceSlit xsi:type="fixedDivergenceSlitType">
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<angle unit="deg">1.000</angle>
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</divergenceSlit>
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</incidentBeamPath>
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<diffractedBeamPath>
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<radius unit="mm">240.000</radius>
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<receivingSlit>
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<height unit="mm">0.100</height>
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</receivingSlit>
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</diffractedBeamPath>
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<scan appendNumber="0" mode="Continuous" scanAxis="Gonio" status="Completed">
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<header>
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<startTimeStamp>2024-10-09T22:21:58</startTimeStamp>
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<author>
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<name>Paul</name>
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</author>
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<source>
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<applicationSoftware version="3.0.5">HighScore Plus</applicationSoftware>
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</source>
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</header>
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<dataPoints>
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<positions axis="2Theta" unit="deg">
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<startPosition>5.015</startPosition>
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<endPosition>89.981</endPosition>
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</positions>
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<commonCountingTime unit="seconds">86.995</commonCountingTime>
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<intensities unit="counts">823 720 970 945 735 1067 906 928 804 839 936 865 945 967 866 914 880 768 762 845 896 871 827 794 900 853 852 904 862 868 827 823 886 848 861 901 798 802 795 792 766 844 783 775 809 840 799 852 776 790 844 856 855 771 670 838 876 772 600 694 702 753 732 766 614 699 779 583 704 742 718 793 789 798 751 670 749 699 668 722 674 658 641 668 651 648 720 732 653 679 681 716 674 672 618 602 736 729 762 733 708 531 708 692 615 646 638 627 581 833 670 641 704 746 652 750 653 598 665 548 697 640 650 580 537 610 624 594 626 674 693 647 585 621 604 635 589 630 587 550 544 551 581 542 559 597 525 582 653 592 530 528 544 514 526 549 560 589 567 554 567 570 574 584 564 543 513 573 635 539 546 592 440 674 614 541 518 559 499 548 657 616 536 596 489 585 529 498 600 584 646 582 525 504 512 510 564 541 508 551 536 523 479 472 524 520 497 440 437 441 438 560 514 464 501 492 473 564 451 420 493 527 448 454 448 407 451 405 435 581 466 446 456 516 585 409 392 435 477 474 460 460 449 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82 83 81 85 84 85 81 90 101 104 131 120 135 135 154 146 154 147 155 139 153 182 217 246 229 243 189 182 158 123 109 99 75 108 82 95 90 86 80 79 78 86 80 78 77 77 72 63 68 75 76 72 77 74 72 78 81 80 78 83 95 92 100 118 138 143 163 199 285 259 254 253 215 201 191 178 211 230 243 240 235 210 158 141 121 99 97 84 82 78 77 77 89 82 74 77 67 67 73 75 69 74 81 74 65 65 72 67 64 58 66 71 71 65 64 65 66 56 59 55 59 63 55 62 63 58 70 65 64 64 66 73 62 59 70 70 64 62 62 64 70 69 63 81 60 58 66 76 85 75 62 65 67 66 67 63 68 65 63 71 73 75 75 70 73 77 86 87 93 98 91 86 104 108 115 130 125 126 137 122 131 148 170 195 232 280 345 411 465 450 454 418 356 281 227 200 175 146 123 109 105 103 113 117 121 145 133 137 138 119 105 99 95 92 80 91 82 84 79 77 79 78 75 76 81 91 100 96 98 118 109 93 95 101 85 82 82 85 83 72 63 72 74 75 70 52 56 64 63 66 68 59 56 74 70 62 60 69 64 65 75 65 61 61 58 65 71 62 82 83 71 70 78 76 83 82 81 90 100 113 128 143 153 161 154 148 135 120 123 134 135 155 185 214 253 270 233 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54
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55
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59
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60
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61
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