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mystruct2
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mystruct2
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CAu
1.00000000000000
14.8010520000000003 0.0000000000000000 0.0000000000000000
-7.4005260000000002 12.8180870000000002 0.0000000000000000
0.0000000000000000 0.0000000000000000 25.0019999999999989
C Au
71 12
Selective dynamics
Direct
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