$cell vectors
1.0
  3.3959984020401435    0.0000000000000000    0.0000000000000000
 -1.6979992010200717    2.9410208873781261    0.0000000000000000
  0.0000000000000000    0.0000000000000000    5.0919976040013033
 1 1 1
Direct
  0.0000000000000000    0.0000000000000000    0.0000000000000000 # Au1
  0.0000000000000000    0.0000000000000000    0.4040000000000003 # C1
  0.0000000000000000    0.0000000000000000    0.6419999999999999 # N1
