quantum-espresso/NEB/examples/ESM_example/reference/Al001+H_pbc.xyz

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Al 0.0000000000 0.0000000000 0.0000000000
Al 2.8634511297 0.0000000000 0.0000000000
Al 0.0000000000 2.8634511297 0.0000000000
Al 2.8634511297 2.8634511297 0.0000000000
H 0.0000000000 0.0000000000 1.6460341083
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Al 0.0000000000 0.0000000000 0.0000000000
Al 2.8634511297 0.0000000000 0.0000000000
Al 0.0000000000 2.8634511297 0.0000000000
Al 2.8634511297 2.8634511297 0.0000000000
H 0.7365149826 0.7365149826 1.3199086740
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Al 0.0000000000 0.0000000000 0.0000000000
Al 2.8634511297 0.0000000000 0.0000000000
Al 0.0000000000 2.8634511297 0.0000000000
Al 2.8634511297 2.8634511297 0.0000000000
H 1.4317251349 1.4317251349 0.8140937791
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Al 0.0000000000 0.0000000000 0.0000000000
Al 2.8634511297 0.0000000000 0.0000000000
Al 0.0000000000 2.8634511297 0.0000000000
Al 2.8634511297 2.8634511297 0.0000000000
H 2.1269365609 2.1269365609 1.3199088793
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Al 0.0000000000 0.0000000000 0.0000000000
Al 2.8634511297 0.0000000000 0.0000000000
Al 0.0000000000 2.8634511297 0.0000000000
Al 2.8634511297 2.8634511297 0.0000000000
H 2.8634511297 2.8634511297 1.6460341083