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"structure_string": "W2 S16 Cl12\n1.0\n7.934060 0.000255 -0.060608\n-0.015015 7.954894 -0.060661\n-2.326220 -1.484950 12.031917\nW S Cl\n2 16 12\ndirect\n0.712505 0.224145 0.894401 W\n0.287496 0.775854 0.105599 W\n0.379436 0.508368 0.598211 S\n0.620565 0.491631 0.401789 S\n0.762053 0.598650 0.302520 S\n0.019944 0.590118 0.374620 S\n0.980057 0.409881 0.625380 S\n0.122714 0.383397 0.294426 S\n0.877287 0.616602 0.705574 S\n0.237948 0.401349 0.697480 S\n0.870318 0.815571 0.610986 S\n0.917759 0.025733 0.324006 S\n0.082242 0.974266 0.675994 S\n0.728503 0.085215 0.415942 S\n0.271498 0.914784 0.584058 S\n0.555291 0.242932 0.333627 S\n0.444709 0.757067 0.666373 S\n0.129683 0.184428 0.389014 S\n0.007383 0.687582 0.100190 Cl\n0.992618 0.312416 0.899810 Cl\n0.372503 0.497423 0.105176 Cl\n0.627498 0.502576 0.894824 Cl\n0.567467 0.864190 0.110692 Cl\n0.240113 0.742600 0.914236 Cl\n0.342259 0.811797 0.298388 Cl\n0.657742 0.188202 0.701612 Cl\n0.759888 0.257399 0.085764 Cl\n0.801425 0.947116 0.893780 Cl\n0.432534 0.135809 0.889309 Cl\n0.198576 0.052883 0.106220 Cl\n",
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"structure_string": "Sm4 As8 O18\n1.0\n6.843880 0.013273 0.103011\n-1.919626 7.365816 -0.105372\n-2.269564 -1.659648 9.082657\nSm As O\n4 8 18\ndirect\n0.245937 0.944550 0.621020 Sm\n0.754063 0.055450 0.378981 Sm\n0.725754 0.532181 0.407976 Sm\n0.274246 0.467819 0.592025 Sm\n0.194015 0.643541 0.287934 As\n0.805985 0.356459 0.712067 As\n0.744598 0.920658 0.718453 As\n0.255402 0.079342 0.281548 As\n0.173258 0.762005 0.925833 As\n0.323598 0.239007 0.944504 As\n0.676402 0.760993 0.055497 As\n0.826742 0.237995 0.074168 As\n0.158409 0.130368 0.439546 O\n0.906548 0.332086 0.551534 O\n0.093452 0.667914 0.448467 O\n0.624200 0.464579 0.629825 O\n0.375800 0.535421 0.370176 O\n0.510819 0.225641 0.323182 O\n0.489181 0.774359 0.676818 O\n0.841591 0.869632 0.560454 O\n0.313574 0.989235 0.889003 O\n0.118476 0.662107 0.740072 O\n0.389915 0.671844 0.008434 O\n0.610085 0.328156 0.991566 O\n0.686427 0.010765 0.110998 O\n0.371942 0.895273 0.352158 O\n0.266058 0.254831 0.757107 O\n0.733943 0.745169 0.242894 O\n0.881524 0.337893 0.259928 O\n0.628058 0.104727 0.647842 O\n",
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{
"id": "jvasp-23694",
"created_at": "2022-09-04T14:38:35.451452Z",
"updated_at": "2022-09-04T14:38:35.451479Z",
"structure_string": "Ba6 Na2 Ir4 O18\n1.0\n2.954374 -5.117126 0.000000\n2.954374 5.117126 -0.000000\n-0.000000 -0.000000 14.575988\nBa Na Ir O\n6 2 4 18\ndirect\n0.333332 0.666667 0.084028 Ba\n0.000000 0.000000 0.250000 Ba\n0.666667 0.333332 0.584028 Ba\n0.666667 0.333332 0.915972 Ba\n0.000000 0.000000 0.750000 Ba\n0.333332 0.666667 0.415972 Ba\n0.000000 0.000000 0.500000 Na\n0.000000 0.000000 0.000000 Na\n0.666667 0.333332 0.161268 Ir\n0.666667 0.333332 0.338732 Ir\n0.333332 0.666667 0.838732 Ir\n0.333332 0.666667 0.661268 Ir\n0.489659 0.979320 0.750000 O\n0.510340 0.020679 0.250000 O\n0.510340 0.489659 0.250000 O\n0.020679 0.510340 0.750000 O\n0.643215 0.821607 0.588184 O\n0.821607 0.178391 0.088184 O\n0.821607 0.643215 0.088184 O\n0.178392 0.356784 0.588184 O\n0.178392 0.356784 0.911817 O\n0.356784 0.178392 0.411816 O\n0.821607 0.178391 0.411816 O\n0.356784 0.178392 0.088184 O\n0.821607 0.643215 0.411816 O\n0.489659 0.510340 0.750000 O\n0.643215 0.821607 0.911817 O\n0.178391 0.821607 0.911817 O\n0.178391 0.821607 0.588184 O\n0.979320 0.489659 0.250000 O\n",
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{
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"created_at": "2022-09-04T14:38:44.133760Z",
"updated_at": "2022-09-04T14:38:44.133777Z",
"structure_string": "Ba6 Zn2 Ru2 Ir2 O18\n1.0\n5.816679 0.000000 0.000000\n-2.908340 5.037391 0.000000\n-0.000000 -0.000000 14.261742\nBa Zn Ru Ir O\n6 2 2 2 18\ndirect\n0.000000 0.000000 0.249119 Ba\n0.000000 0.000000 0.750881 Ba\n0.333333 0.666666 0.587180 Ba\n0.666667 0.333333 0.412820 Ba\n0.666667 0.333333 0.085759 Ba\n0.333333 0.666666 0.914241 Ba\n0.000000 0.000000 0.500000 Zn\n0.000000 0.000000 0.000000 Zn\n0.666667 0.333333 0.657729 Ru\n0.333333 0.666666 0.342271 Ru\n0.333333 0.666666 0.161059 Ir\n0.666667 0.333333 0.838941 Ir\n0.172768 0.827232 0.415932 O\n0.345536 0.172768 0.584068 O\n0.827232 0.654464 0.584068 O\n0.827232 0.172768 0.584068 O\n0.342777 0.171388 0.915939 O\n0.828612 0.657222 0.915939 O\n0.828612 0.171388 0.915939 O\n0.657223 0.828612 0.084061 O\n0.019764 0.509882 0.251677 O\n0.171388 0.828612 0.084061 O\n0.980236 0.490118 0.748323 O\n0.509882 0.019764 0.748323 O\n0.509882 0.490118 0.748323 O\n0.172768 0.345536 0.415932 O\n0.490118 0.980236 0.251677 O\n0.490118 0.509882 0.251677 O\n0.171388 0.342777 0.084061 O\n0.654464 0.827232 0.415932 O\n",
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{
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"structure_string": "Sr6 Si6 O18\n1.0\n6.778771 0.000410 2.276118\n2.987896 6.084753 2.276118\n-0.020733 -0.012918 10.990346\nSr Si O\n6 6 18\ndirect\n0.327945 0.845136 0.500899 Sr\n0.672056 0.154864 0.499102 Sr\n0.845136 0.327944 0.000899 Sr\n0.500000 0.000000 0.000000 Sr\n0.000001 0.500000 0.500000 Sr\n0.154865 0.672056 0.999102 Sr\n0.581885 0.667904 0.753871 Si\n0.332096 0.418116 0.746130 Si\n0.418117 0.332095 0.246130 Si\n0.667905 0.581883 0.253871 Si\n0.833787 0.166213 0.750000 Si\n0.166214 0.833786 0.250000 Si\n0.181623 0.371680 0.884823 O\n0.628320 0.818377 0.615178 O\n0.719445 0.534713 0.396005 O\n0.632982 0.367018 0.250000 O\n0.534714 0.719444 0.896005 O\n0.371681 0.181622 0.384823 O\n0.818378 0.628319 0.115177 O\n0.797948 0.417151 0.751722 O\n0.582849 0.202052 0.748279 O\n0.202053 0.582849 0.248279 O\n0.417152 0.797947 0.251722 O\n0.983500 0.111345 0.610224 O\n0.888655 0.016500 0.889777 O\n0.016501 0.888654 0.389777 O\n0.111346 0.983500 0.110224 O\n0.367019 0.632982 0.750000 O\n0.280556 0.465286 0.603995 O\n0.465287 0.280555 0.103995 O\n",
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{
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"structure_string": "Ce6 Mg23 Sn1\n1.0\n8.859053 0.000000 5.114777\n2.953018 8.352395 5.114777\n-0.000000 -0.000000 10.229553\nCe Mg Sn\n6 23 1\ndirect\n0.781293 0.781293 0.218707 Ce\n0.218707 0.781293 0.218707 Ce\n0.781293 0.218707 0.218707 Ce\n0.218707 0.218707 0.781293 Ce\n0.781293 0.218707 0.781293 Ce\n0.218707 0.781293 0.781293 Ce\n0.376939 0.869181 0.376939 Mg\n0.869181 0.376940 0.376940 Mg\n0.376939 0.376940 0.376939 Mg\n0.000000 0.000000 0.500000 Mg\n0.500000 0.500000 0.000000 Mg\n0.000000 0.500000 0.500000 Mg\n0.376939 0.376940 0.869181 Mg\n0.000000 0.500000 0.000000 Mg\n0.500000 0.000000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.623060 0.623061 0.623061 Mg\n0.623060 0.623061 0.130820 Mg\n0.623060 0.130819 0.623061 Mg\n0.500000 0.500000 0.500000 Mg\n0.166481 0.166481 0.166481 Mg\n0.500555 0.166481 0.166482 Mg\n0.166481 0.500555 0.166481 Mg\n0.166481 0.166481 0.500555 Mg\n0.833518 0.833519 0.833519 Mg\n0.499445 0.833519 0.833519 Mg\n0.833518 0.499445 0.833519 Mg\n0.833518 0.833519 0.499445 Mg\n0.130819 0.623061 0.623060 Mg\n0.000000 0.000000 0.000000 Sn\n",
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"structure_string": "Li3 V3 Si6 O18\n1.0\n7.126753 0.019796 1.507421\n-0.363694 6.434512 -3.439408\n-0.078561 0.046013 7.023319\nLi V Si O\n3 3 6 18\ndirect\n0.241817 0.760446 0.376443 Li\n0.500000 0.500000 0.500000 Li\n0.758184 0.239553 0.623557 Li\n0.226202 0.741840 0.953249 V\n0.500000 0.500000 -0.000000 V\n0.773798 0.258160 0.046750 V\n0.830944 0.709669 0.760086 Si\n0.842429 0.754136 0.322347 Si\n0.386309 0.018050 0.795083 Si\n0.157571 0.245864 0.677652 Si\n0.169056 0.290331 0.239914 Si\n0.613692 0.981950 0.204917 Si\n0.726467 0.959805 0.375749 O\n0.829511 0.752043 0.553217 O\n0.764610 0.932258 0.976158 O\n0.673270 0.523682 0.755295 O\n0.561454 0.192172 0.852857 O\n0.716359 0.555620 0.163677 O\n0.579533 0.220630 0.282622 O\n0.273533 0.040195 0.624250 O\n0.170489 0.247957 0.446783 O\n0.283641 0.444380 0.836322 O\n0.438547 0.807828 0.147142 O\n0.326730 0.476318 0.244705 O\n0.235390 0.067741 0.023841 O\n0.963385 0.333799 0.227656 O\n0.036615 0.666201 0.772344 O\n0.057426 0.770766 0.219315 O\n0.420468 0.779370 0.717378 O\n0.942574 0.229234 0.780685 O\n",
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