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"structure_string": "Ba6 Sc4 N8\n1.0\n7.619415 0.110699 -0.370405\n-6.276085 7.390182 -0.000000\n-0.007006 -0.005949 6.442785\nBa Sc N\n6 4 8\ndirect\n0.229405 0.962906 0.075724 Ba\n0.770594 0.733500 0.424276 Ba\n0.770594 0.037094 0.924276 Ba\n0.229406 0.266500 0.575724 Ba\n-0.000001 0.596370 0.750001 Ba\n-0.000000 0.403630 0.250000 Ba\n0.563584 0.394968 0.079384 Sc\n0.436415 0.831383 0.420616 Sc\n0.563584 0.168616 0.579384 Sc\n0.436415 0.605032 0.920616 Sc\n0.364118 0.748002 0.100285 N\n0.245080 0.913597 0.504853 N\n0.754919 0.668517 -0.004854 N\n0.754920 0.086403 0.495147 N\n0.245080 0.331483 0.004853 N\n0.635882 0.251998 0.899715 N\n0.364117 0.616117 0.600285 N\n0.635882 0.383883 0.399715 N\n",
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"structure_string": "Ba6 Si6 O18\n1.0\n2.752265 -4.767063 0.000000\n2.752265 4.767063 -0.000000\n-0.000000 -0.000000 13.256598\nBa Si O\n6 6 18\ndirect\n0.333334 0.666668 0.595812 Ba\n0.666668 0.333334 0.095812 Ba\n0.666668 0.333334 0.404188 Ba\n0.333334 0.666668 0.904188 Ba\n0.000000 0.000000 0.250000 Ba\n0.000000 0.000000 0.750000 Ba\n0.000000 0.000000 0.000000 Si\n0.000000 0.000000 0.500000 Si\n0.333334 0.666668 0.155545 Si\n0.666668 0.333334 0.844456 Si\n0.333334 0.666668 0.344456 Si\n0.666668 0.333334 0.655545 Si\n0.666642 0.833321 0.420068 O\n0.950761 0.475381 0.750000 O\n0.049241 0.524620 0.250000 O\n0.475381 0.950761 0.250000 O\n0.524621 0.475381 0.750000 O\n0.833320 0.166681 0.920068 O\n0.166681 0.333360 0.420068 O\n0.333360 0.166681 0.920068 O\n0.333360 0.166681 0.579932 O\n0.166681 0.833320 0.079932 O\n0.166681 0.333360 0.079932 O\n0.166681 0.833320 0.420068 O\n0.666642 0.833321 0.079932 O\n0.524620 0.049241 0.750000 O\n0.833320 0.166681 0.579932 O\n0.833321 0.666642 0.579932 O\n0.833321 0.666642 0.920068 O\n0.475381 0.524621 0.250000 O\n",
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"structure_string": "Ba6 Sm2\n1.0\n8.317359 0.000000 0.000000\n-4.158680 7.203044 0.000000\n-0.000000 -0.000000 6.639294\nBa Sm\n6 2\ndirect\n0.828361 0.171639 0.750000 Ba\n0.343278 0.171639 0.750000 Ba\n0.828361 0.656722 0.750000 Ba\n0.171639 0.828361 0.250000 Ba\n0.656722 0.828361 0.250000 Ba\n0.171639 0.343278 0.250000 Ba\n0.666667 0.333333 0.250000 Sm\n0.333333 0.666666 0.750000 Sm\n",
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"structure_string": "Ba6 Sm2 In2 S12\n1.0\n8.437971 0.008086 -0.370574\n-0.387560 8.429069 -0.370574\n0.007715 0.008086 8.446101\nBa Sm In S\n6 2 2 12\ndirect\n0.868224 0.631777 0.250001 Ba\n0.250000 0.868224 0.631777 Ba\n0.631777 0.250001 0.868224 Ba\n0.750000 0.131777 0.368224 Ba\n0.368224 0.750000 0.131777 Ba\n0.131777 0.368224 0.750000 Ba\n0.250000 0.250000 0.250000 Sm\n0.750000 0.750001 0.750001 Sm\n0.500000 0.500001 0.500000 In\n0.000000 0.000000 0.000000 In\n0.087840 0.958814 0.301919 S\n0.458815 0.587841 0.801919 S\n0.587840 0.801919 0.458815 S\n0.801919 0.458815 0.587841 S\n0.041186 0.698082 0.912160 S\n0.198081 0.541186 0.412160 S\n0.912160 0.041187 0.698082 S\n0.541186 0.412160 0.198082 S\n0.412160 0.198082 0.541186 S\n0.301919 0.087841 0.958814 S\n0.698081 0.912161 0.041187 S\n0.958814 0.301919 0.087841 S\n",
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