iterations/neb0_image03_iter44_CONTCAR output for 564: 4940072_SO2_t_3990147
Status:
finished
No title
1.00000000000000
11.0868990899999993 0.0000000000000000 0.0000000000000000
5.5434492400000002 9.6015364400000003 0.0000000000000000
0.0000000000000000 0.0000000000000000 29.0524118199999997
Pt H O S
64 4 4 1
Direct
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