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{
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{
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"structure_string": "Mn8 P16 O40\n1.0\n7.792612 0.000000 0.000000\n0.000000 11.654022 0.000000\n0.000000 7.681604 13.360222\nMn P O\n8 16 40\ndirect\n0.610405 0.346707 0.682808 Mn\n0.889595 0.346707 0.182808 Mn\n0.389595 0.653293 0.317192 Mn\n0.110405 0.653293 0.817192 Mn\n0.764174 0.179412 0.954692 Mn\n0.735826 0.179412 0.454692 Mn\n0.235826 0.820588 0.045308 Mn\n0.264174 0.820588 0.545308 Mn\n0.953274 0.468525 0.732711 P\n0.546726 0.468525 0.232711 P\n0.046726 0.531475 0.267289 P\n0.453274 0.531475 0.767289 P\n0.732535 0.642990 0.456253 P\n0.767465 0.642990 0.956253 P\n0.267465 0.357010 0.543747 P\n0.232535 0.357010 0.043747 P\n0.677704 0.864206 0.135613 P\n0.822296 0.864206 0.635613 P\n0.322296 0.135794 0.864387 P\n0.177704 0.135794 0.364387 P\n0.663570 0.080388 0.277286 P\n0.836430 0.080388 0.777286 P\n0.336430 0.919612 0.722714 P\n0.163570 0.919612 0.222714 P\n0.967117 0.513070 0.810168 O\n0.532883 0.513070 0.310168 O\n0.032883 0.486930 0.189832 O\n0.467117 0.486930 0.689832 O\n0.797100 0.375000 0.761305 O\n0.702900 0.375000 0.261305 O\n0.202900 0.625000 0.238695 O\n0.297100 0.625000 0.738695 O\n0.717750 0.505147 0.545074 O\n0.782250 0.505147 0.045074 O\n0.282250 0.494853 0.454926 O\n0.217750 0.494853 0.954926 O\n0.587879 0.691507 0.378646 O\n0.912121 0.691507 0.878646 O\n0.412121 0.308493 0.621354 O\n0.087879 0.308493 0.121354 O\n0.664851 0.011141 0.057103 O\n0.835149 0.011141 0.557103 O\n0.335149 0.988859 0.942897 O\n0.164851 0.988859 0.442897 O\n0.501047 0.801771 0.166915 O\n0.998953 0.801771 0.666915 O\n0.498953 0.198229 0.833085 O\n0.001047 0.198229 0.333085 O\n0.667641 0.080080 0.375231 O\n0.832359 0.080080 0.875231 O\n0.332359 0.919920 0.624769 O\n0.167641 0.919920 0.124769 O\n0.754262 0.197451 0.188659 O\n0.745738 0.197451 0.688659 O\n0.245738 0.802549 0.811341 O\n0.254262 0.802549 0.311341 O\n0.631378 0.283034 0.960106 O\n0.868622 0.283034 0.460106 O\n0.368622 0.716966 0.039894 O\n0.131378 0.716966 0.539894 O\n0.967692 0.191895 0.973330 O\n0.532308 0.191895 0.473330 O\n0.032308 0.808105 0.026670 O\n0.467692 0.808105 0.526670 O\n",
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{
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"created_at": "2022-09-04T14:39:12.610695Z",
"structure_string": "V4 Ni4 P8 O36\n1.0\n6.276206 0.000000 0.000000\n0.000000 7.817096 0.000000\n0.000000 0.000000 13.928293\nV Ni P O\n4 4 8 36\ndirect\n0.750000 0.844626 0.380614 V\n0.250000 0.155374 0.619386 V\n0.250000 0.344626 0.119386 V\n0.750000 0.655374 0.880614 V\n0.500000 0.500000 0.500000 Ni\n0.500000 0.000000 0.000000 Ni\n0.000000 0.000000 0.000000 Ni\n0.000000 0.500000 0.500000 Ni\n0.250000 0.849112 0.440177 P\n0.750000 0.150888 0.559823 P\n0.750000 0.349112 0.059823 P\n0.250000 0.650888 0.940177 P\n0.750000 0.890245 0.189552 P\n0.250000 0.109755 0.810448 P\n0.250000 0.390245 0.310448 P\n0.750000 0.609755 0.689552 P\n0.047574 0.106738 0.871674 O\n0.547574 0.893262 0.128326 O\n0.952426 0.606738 0.628326 O\n0.452426 0.393262 0.371674 O\n0.952426 0.893262 0.128326 O\n0.452426 0.106738 0.871674 O\n0.047574 0.393262 0.371674 O\n0.547574 0.606738 0.628326 O\n0.250000 0.834194 0.980624 O\n0.750000 0.165806 0.019376 O\n0.750000 0.334194 0.519376 O\n0.250000 0.665806 0.480624 O\n0.750000 0.659435 0.444036 O\n0.250000 0.340565 0.555964 O\n0.250000 0.159435 0.055964 O\n0.750000 0.840565 0.944036 O\n0.750000 0.728951 0.258618 O\n0.250000 0.271049 0.741382 O\n0.250000 0.228951 0.241382 O\n0.750000 0.771049 0.758618 O\n0.448874 0.628196 0.875677 O\n0.948874 0.371804 0.124323 O\n0.551126 0.128196 0.624323 O\n0.051126 0.871804 0.375677 O\n0.551126 0.371804 0.124323 O\n0.051126 0.628196 0.875677 O\n0.448874 0.871804 0.375677 O\n0.948874 0.128196 0.624323 O\n0.750000 0.466895 0.768242 O\n0.250000 0.533105 0.231758 O\n0.250000 0.966895 0.731758 O\n0.750000 0.033105 0.268242 O\n0.750000 0.487160 0.981348 O\n0.250000 0.512840 0.018652 O\n0.250000 0.987160 0.518652 O\n0.750000 0.012840 0.481348 O\n",
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{
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"structure_string": "Ba12 Sn8 As16\n1.0\n20.155522 0.000000 0.000000\n0.000000 8.066997 0.000000\n0.000000 3.095579 7.572761\nBa Sn As\n12 8 16\ndirect\n0.317046 0.009350 0.786909 Ba\n0.817046 0.490650 0.213091 Ba\n0.682954 0.990650 0.213091 Ba\n0.182954 0.509350 0.786909 Ba\n0.439288 0.994907 0.261675 Ba\n0.939288 0.505093 0.738325 Ba\n0.560712 0.005093 0.738325 Ba\n0.060712 0.494907 0.261675 Ba\n0.436801 0.511195 0.742593 Ba\n0.936801 0.988805 0.257407 Ba\n0.563199 0.488805 0.257407 Ba\n0.063199 0.011195 0.742593 Ba\n0.623297 0.525719 0.789943 Sn\n0.123297 0.974281 0.210057 Sn\n0.376703 0.474281 0.210057 Sn\n0.876703 0.025719 0.789943 Sn\n0.741905 0.400659 0.683381 Sn\n0.758095 0.900659 0.683381 Sn\n0.258095 0.599341 0.316619 Sn\n0.241905 0.099341 0.316619 Sn\n0.435797 0.253853 0.498151 As\n0.935797 0.246147 0.501849 As\n0.564203 0.746147 0.501849 As\n0.064203 0.753853 0.498151 As\n0.445181 0.750589 0.001016 As\n0.945181 0.749411 0.998984 As\n0.554819 0.249411 0.998984 As\n0.054819 0.250589 0.001016 As\n0.182875 0.784117 0.035378 As\n0.682875 0.715883 0.964622 As\n0.817125 0.215883 0.964622 As\n0.317125 0.284117 0.035378 As\n0.800934 0.715456 0.487658 As\n0.699066 0.215456 0.487658 As\n0.199066 0.284544 0.512342 As\n0.300934 0.784544 0.512342 As\n",
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{
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"structure_string": "Nd4 Co2 Ni2 O12\n1.0\n5.619934 0.000000 0.000000\n0.000000 5.428347 0.000000\n0.000000 5.406908 7.684653\nNd Co Ni O\n4 2 2 12\ndirect\n0.555418 0.735961 0.750401 Nd\n0.055418 0.264039 0.749599 Nd\n0.444582 0.264039 0.249599 Nd\n0.944582 0.735961 0.250401 Nd\n0.500000 0.000000 0.000000 Co\n0.000000 0.000000 0.500000 Co\n0.500000 0.500000 0.500000 Ni\n0.000000 0.500000 0.000000 Ni\n0.792072 0.254043 0.954163 O\n0.292072 0.745957 0.545837 O\n0.200050 0.324005 0.457532 O\n0.700050 0.675995 0.042468 O\n0.207928 0.745957 0.045837 O\n0.707928 0.254043 0.454163 O\n0.799950 0.675995 0.542468 O\n0.299950 0.324005 0.957532 O\n0.979616 0.838857 0.743250 O\n0.479616 0.161143 0.756750 O\n0.020384 0.161143 0.256750 O\n0.520384 0.838857 0.243250 O\n",
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{
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"structure_string": "K40 Ga8 Se32\n1.0\n12.782463 0.000000 0.000000\n0.000000 13.047158 0.000000\n0.000000 0.000000 15.909009\nK Ga Se\n40 8 32\ndirect\n0.054028 0.340011 0.278029 K\n0.554028 0.159989 0.721971 K\n0.945972 0.840011 0.221971 K\n0.445972 0.659989 0.778029 K\n0.945972 0.659989 0.721971 K\n0.445972 0.840011 0.278029 K\n0.054028 0.159989 0.778029 K\n0.554028 0.340011 0.221971 K\n0.386518 0.014141 0.058928 K\n0.886518 0.485859 0.941072 K\n0.613482 0.514141 0.441072 K\n0.113482 0.985859 0.558928 K\n0.613482 0.985859 0.941072 K\n0.113482 0.514141 0.058928 K\n0.386518 0.485859 0.558928 K\n0.886518 0.014141 0.441072 K\n0.058909 0.070384 0.109363 K\n0.558909 0.429616 0.890637 K\n0.941091 0.570384 0.390637 K\n0.441091 0.929616 0.609363 K\n0.941091 0.929616 0.890637 K\n0.441091 0.570384 0.109363 K\n0.058909 0.429616 0.609363 K\n0.558909 0.070384 0.390637 K\n0.179555 0.647494 0.268377 K\n0.679555 0.852506 0.731623 K\n0.820445 0.147494 0.231623 K\n0.320445 0.352506 0.768377 K\n0.820445 0.352506 0.731623 K\n0.320445 0.147494 0.268377 K\n0.179555 0.852506 0.768377 K\n0.679555 0.647494 0.231623 K\n0.271878 0.788573 0.984604 K\n0.771878 0.711427 0.015396 K\n0.728122 0.288573 0.515396 K\n0.228122 0.211427 0.484604 K\n0.728122 0.211427 0.015396 K\n0.228122 0.288573 0.984604 K\n0.271878 0.711427 0.484604 K\n0.771878 0.788573 0.515396 K\n0.164639 0.934709 0.335643 Ga\n0.664639 0.565291 0.664357 Ga\n0.835361 0.434709 0.164357 Ga\n0.335361 0.065291 0.835643 Ga\n0.835361 0.065291 0.664357 Ga\n0.335361 0.434709 0.335643 Ga\n0.164639 0.565291 0.835643 Ga\n0.664639 0.934709 0.164357 Ga\n0.069999 0.098423 0.321905 Se\n0.569999 0.401577 0.678095 Se\n0.930001 0.598423 0.178095 Se\n0.430001 0.901577 0.821905 Se\n0.930001 0.901577 0.678095 Se\n0.430001 0.598423 0.321905 Se\n0.069999 0.401577 0.821905 Se\n0.569999 0.098423 0.178095 Se\n0.319204 0.965248 0.427162 Se\n0.819204 0.534752 0.572838 Se\n0.680796 0.465248 0.072838 Se\n0.180796 0.034752 0.927162 Se\n0.680796 0.034752 0.572838 Se\n0.180796 0.465248 0.427162 Se\n0.319204 0.534752 0.927162 Se\n0.819204 0.965248 0.072838 Se\n0.214085 0.884801 0.191219 Se\n0.714085 0.615199 0.808781 Se\n0.785915 0.384801 0.308781 Se\n0.285915 0.115199 0.691219 Se\n0.785915 0.115199 0.808781 Se\n0.285915 0.384801 0.191219 Se\n0.214085 0.615199 0.691219 Se\n0.714085 0.884801 0.308781 Se\n0.054384 0.808404 0.408851 Se\n0.554384 0.691596 0.591149 Se\n0.945616 0.308404 0.091149 Se\n0.445616 0.191596 0.908851 Se\n0.945616 0.191596 0.591149 Se\n0.445616 0.308404 0.408851 Se\n0.054384 0.691596 0.908851 Se\n0.554384 0.808404 0.091149 Se\n",
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{
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"structure_string": "Y1 Cr2 Si2 C1\n1.0\n3.965421 0.000000 0.000000\n0.000000 3.965421 0.000000\n0.000000 0.000000 5.256871\nY Cr Si C\n1 2 2 1\ndirect\n0.000000 0.000000 0.500000 Y\n0.000000 0.500000 0.000000 Cr\n0.500000 0.000000 0.000000 Cr\n0.500000 0.500000 0.271013 Si\n0.500000 0.500000 0.728987 Si\n0.000000 0.000000 0.000000 C\n",
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{
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{
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}