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{
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{
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"structure_string": "Ni1 C2 S2 N2\n1.0\n3.645291 0.000000 0.000000\n-1.822645 5.028556 -1.317319\n0.000000 0.191164 5.967394\nNi C S N\n1 2 2 2\ndirect\n0.000000 0.000000 0.000000 Ni\n0.241690 0.483380 0.785040 C\n0.758309 0.516621 0.214959 C\n0.610446 0.220894 0.269095 S\n0.389552 0.779106 0.730904 S\n0.138208 0.276417 0.833878 N\n0.861790 0.723583 0.166121 N\n",
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{
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{
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"structure_string": "Nd6 U2 Cl6 O12\n1.0\n4.704731 -8.148833 0.000000\n4.704731 8.148833 -0.000000\n-0.000000 -0.000000 5.568289\nNd U Cl O\n6 2 6 12\ndirect\n0.596021 0.908064 0.750000 Nd\n0.403979 0.091936 0.250000 Nd\n0.091936 0.687957 0.750000 Nd\n0.312043 0.403979 0.750000 Nd\n0.687957 0.596021 0.250000 Nd\n0.908064 0.312043 0.250000 Nd\n0.666667 0.333333 0.750000 U\n0.333333 0.666667 0.250000 U\n0.812342 0.753384 0.750000 Cl\n0.058958 0.812342 0.250000 Cl\n0.753384 0.941042 0.250000 Cl\n0.941042 0.187658 0.750000 Cl\n0.187658 0.246616 0.250000 Cl\n0.246616 0.058958 0.750000 Cl\n0.515046 0.364510 0.504641 O\n0.635490 0.150536 0.504641 O\n0.150536 0.515046 0.004641 O\n0.515046 0.364510 0.995359 O\n0.849464 0.484954 0.995359 O\n0.364510 0.849464 0.004641 O\n0.484954 0.635490 0.495359 O\n0.364510 0.849464 0.495359 O\n0.484954 0.635490 0.004641 O\n0.849464 0.484954 0.504641 O\n0.150536 0.515046 0.495359 O\n0.635490 0.150536 0.995359 O\n",
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{
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{
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"structure_string": "Nd2 Ti2 S2 O5\n1.0\n3.812820 0.000000 -0.627617\n-0.103311 3.811434 -0.627619\n0.015532 0.015952 11.989751\nNd Ti S O\n2 2 2 5\ndirect\n0.334044 0.334043 0.668089 Nd\n0.665956 0.665955 0.331911 Nd\n0.077537 0.077537 0.155075 Ti\n0.922462 0.922461 0.844925 Ti\n0.203949 0.203949 0.407897 S\n0.796051 0.796050 0.592102 S\n0.903267 0.403267 0.806535 O\n0.096732 0.596731 0.193465 O\n0.403268 0.903267 0.806535 O\n0.596732 0.096732 0.193465 O\n0.000000 0.000000 0.000000 O\n",
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]
}