Ba1 W47 S96
1.0
19.144551 0.000000 0.000000
0.000000 22.106223 0.000000
0.000000 0.000000 14.200541
Ba W S
1 47 96
direct
0.000006 0.746873 0.500000 Ba
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0.084184 0.612514 0.500000 W
0.176318 0.755231 0.499999 W
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