1 atom density matrix
    2  0.000000  0.000000  0.000000 L, Lx,Ly,Lz in global orthogonal system
  0.74511278E-01  0.16147433E-36   -0.48789098E-18  0.39302329E-18
 -0.74738296E-03 -0.38149586E-02   -0.92157185E-18  0.13552527E-18
  0.86320777E-02 -0.17769362E-01
 -0.48789098E-18 -0.39302329E-18    0.83072453E-01 -0.11198448E-36
  0.26156377E-17 -0.92157185E-18    0.62613366E-02  0.78018103E-02
  0.92157185E-18 -0.13552527E-18
 -0.74738296E-03  0.38149586E-02    0.26156377E-17  0.92157185E-18
  0.40594149E-01  0.00000000E+00   -0.26156377E-17  0.92157185E-18
 -0.74738296E-03 -0.38149586E-02
 -0.92157185E-18 -0.13552527E-18    0.62613366E-02 -0.78018103E-02
 -0.26156377E-17 -0.92157185E-18    0.83072453E-01  0.11198448E-36
  0.48789098E-18 -0.39302329E-18
  0.86320777E-02  0.17769362E-01    0.92157185E-18  0.13552527E-18
 -0.74738296E-03  0.38149586E-02    0.48789098E-18  0.39302329E-18
  0.74511278E-01 -0.16147433E-36