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{
"id": "jvasp-117536",
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"updated_at": "2022-09-04T14:38:45.983871Z",
"structure_string": "Ba1 Cu1 Br2\n1.0\n4.413407 0.000000 -0.000000\n-0.000000 4.413407 -0.000000\n0.000000 -0.000000 6.268850\nBa Cu Br\n1 1 2\ndirect\n0.500001 0.500001 0.583846 Ba\n0.000000 0.000000 0.956445 Cu\n0.000000 0.000000 0.400085 Br\n0.500001 0.500001 0.069622 Br\n",
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{
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"structure_string": "Ba1 Na1 Cu1 Br1 O2\n1.0\n3.974440 -0.000000 0.000000\n0.000000 3.974440 0.000000\n-0.000000 -0.000000 7.188690\nBa Na Cu Br O\n1 1 1 1 2\ndirect\n0.000000 0.000000 0.472257 Ba\n0.000000 0.000000 0.033410 Na\n0.500000 0.500000 0.210915 Cu\n0.500000 0.500000 0.755728 Br\n-0.000000 0.500000 0.231885 O\n0.500000 0.000000 0.231885 O\n",
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{
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"structure_string": "Ba2 Cu1 Br1 O2\n1.0\n4.208566 -0.013878 9.203932\n1.993377 3.706572 9.203932\n-0.023310 -0.013878 10.120466\nBa Cu Br O\n2 1 1 2\ndirect\n0.747754 0.747751 0.747752 Ba\n0.252251 0.252250 0.252250 Ba\n0.500000 0.499998 0.499998 Cu\n0.000000 0.000000 0.000000 Br\n0.438407 0.438406 0.438406 O\n0.561593 0.561592 0.561592 O\n",
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{
"id": "jvasp-117540",
"created_at": "2022-09-04T14:38:53.347446Z",
"updated_at": "2022-09-04T14:38:53.347474Z",
"structure_string": "Ba1 Br1 F1\n1.0\n6.171874 0.000000 -0.000000\n0.000000 6.171874 -0.000000\n-0.000000 0.000000 9.138333\nBa Br F\n1 1 1\ndirect\n0.000000 0.000000 0.203392 Ba\n0.000000 0.000000 0.528357 Br\n0.000000 0.000000 -0.043558 F\n",
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{
"id": "jvasp-117538",
"created_at": "2022-09-04T14:38:51.241567Z",
"updated_at": "2022-09-04T14:38:51.241596Z",
"structure_string": "Ba2 Br2 F2\n1.0\n4.510890 0.000000 0.000000\n-0.000000 4.510890 -0.000000\n0.000000 0.000000 7.490665\nBa Br F\n2 2 2\ndirect\n0.500000 0.000000 0.806423 Ba\n0.000000 0.500000 0.193577 Ba\n0.000000 0.500000 0.648065 Br\n0.500000 0.000000 0.351935 Br\n0.000000 0.000000 0.000000 F\n0.500000 0.500000 0.000000 F\n",
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{
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"created_at": "2022-09-04T14:35:46.894823Z",
"updated_at": "2022-09-04T14:35:46.894841Z",
"structure_string": "Ba2 Br2 F2\n1.0\n4.527869 0.000000 0.000000\n0.000000 4.527869 0.000000\n0.000000 0.000000 7.480885\nBa Br F\n2 2 2\ndirect\n0.000000 0.500000 0.806384 Ba\n0.500000 0.000000 0.193616 Ba\n0.500000 0.000000 0.648767 Br\n0.000000 0.500000 0.351233 Br\n0.500000 0.500000 0.000000 F\n0.000000 0.000000 0.000000 F\n",
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{
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"created_at": "2022-09-04T14:35:54.844646Z",
"updated_at": "2022-09-04T14:35:54.844669Z",
"structure_string": "Ba4 Fe1 Br1\n1.0\n0.000000 4.985081 4.985081\n4.985081 0.000000 4.985081\n4.985081 4.985081 -0.000000\nBa Fe Br\n4 1 1\ndirect\n0.123488 0.625504 0.625504 Ba\n0.625504 0.625504 0.625504 Ba\n0.625504 0.123488 0.625504 Ba\n0.625504 0.625504 0.123488 Ba\n0.000000 0.000000 0.000000 Fe\n0.250000 0.250000 0.250000 Br\n",
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{
"id": "jvasp-57383",
"created_at": "2022-09-04T14:36:35.792669Z",
"updated_at": "2022-09-04T14:36:35.792687Z",
"structure_string": "Ba6 Fe4 Br4 O10\n1.0\n8.302818 0.000000 -2.935489\n-4.151409 7.190452 -2.935489\n-0.000000 -0.000000 8.806469\nBa Fe Br O\n6 4 4 10\ndirect\n0.651249 0.401249 0.250000 Ba\n0.250000 0.651249 0.401249 Ba\n0.848751 0.098751 0.750000 Ba\n0.401249 0.250000 0.651249 Ba\n0.098751 0.750000 0.848751 Ba\n0.750000 0.848751 0.098751 Ba\n-0.000000 0.312545 0.500000 Fe\n0.187455 0.187455 0.187455 Fe\n0.500000 1.000000 0.312545 Fe\n0.312545 0.500000 1.000000 Fe\n0.500000 0.000000 0.881401 Br\n0.881401 0.500000 -0.000000 Br\n0.618599 0.618599 0.618599 Br\n1.000000 0.881400 0.500000 Br\n0.979048 0.979048 0.979048 O\n0.111874 0.361874 0.750000 O\n1.000000 0.520952 0.500000 O\n0.750000 0.111874 0.361874 O\n0.520952 0.500000 -0.000000 O\n0.138126 0.250000 0.388126 O\n0.250000 0.388126 0.138126 O\n0.388126 0.138126 0.250000 O\n0.361874 0.750000 0.111874 O\n0.500000 0.000000 0.520952 O\n",
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"formula_full": "Ba6 Fe4 Br4 O10",
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{
"id": "jvasp-101234",
"created_at": "2022-09-04T14:36:41.333347Z",
"updated_at": "2022-09-04T14:36:41.333364Z",
"structure_string": "Ba2 I1 Br1 F2\n1.0\n4.587381 -0.000000 0.000000\n0.000000 4.587381 0.000000\n-0.000000 -0.000000 7.890404\nBa I Br F\n2 1 1 2\ndirect\n0.500000 0.500000 0.828437 Ba\n0.000000 0.000000 0.187464 Ba\n0.000000 0.000000 0.640605 I\n0.500000 0.500000 0.336153 Br\n0.500000 0.000000 0.003670 F\n-0.000000 0.500000 0.003670 F\n",
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{
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"created_at": "2022-09-04T14:37:12.372464Z",
"updated_at": "2022-09-04T14:37:12.372495Z",
"structure_string": "Ba2 Pb4 Br2 F10\n1.0\n5.981559 -0.000000 -0.000000\n0.000000 5.981559 0.000000\n-0.000000 -0.000000 9.751756\nBa Pb Br F\n2 4 2 10\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.000000 Ba\n0.500000 0.000000 0.323579 Pb\n0.000000 0.500000 0.676422 Pb\n0.000000 0.500000 0.277928 Pb\n0.500000 0.000000 0.722072 Pb\n0.000000 0.000000 0.500000 Br\n0.500000 0.500000 0.500000 Br\n0.234694 0.734694 0.811948 F\n0.765306 0.265306 0.811948 F\n0.734694 0.234694 0.188052 F\n0.234694 0.265306 0.811948 F\n0.500000 0.000000 0.962764 F\n0.734694 0.765306 0.188052 F\n0.765306 0.734694 0.811948 F\n0.265306 0.765306 0.188052 F\n0.000000 0.500000 0.037236 F\n0.265306 0.234694 0.188052 F\n",
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{
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"created_at": "2022-09-04T14:35:57.250815Z",
"updated_at": "2022-09-04T14:35:57.250840Z",
"structure_string": "Ba1 Ga1 Br2\n1.0\n4.165746 0.000000 0.000000\n0.000000 4.165746 0.000000\n0.000000 -0.000000 7.228889\nBa Ga Br\n1 1 2\ndirect\n0.500001 0.500001 0.500000 Ba\n0.500001 0.500001 0.000000 Ga\n0.000000 0.000000 0.741602 Br\n0.000000 0.000000 0.258398 Br\n",
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