1 atom density matrix 2 0.000000 0.000000 0.000000 L, Lx,Ly,Lz in global orthogonal system 0.20374741E-01 0.16581098E-38 -0.14907780E-18 0.10185571E-18 -0.44056585E-03 -0.12381343E-02 -0.18295912E-18 -0.34728351E-19 0.99770362E-03 -0.42724865E-02 -0.14907780E-18 -0.10185571E-18 0.23291487E-01 -0.13713711E-35 0.67847339E-18 -0.29137933E-18 0.13576138E-02 0.27612672E-02 0.18295912E-18 0.34728351E-19 -0.44056585E-03 0.12381343E-02 0.67847339E-18 0.29137933E-18 0.12461808E-01 0.00000000E+00 -0.67847339E-18 0.29137933E-18 -0.44056585E-03 -0.12381343E-02 -0.18295912E-18 0.34728351E-19 0.13576138E-02 -0.27612672E-02 -0.67847339E-18 -0.29137933E-18 0.23291487E-01 0.13713711E-35 0.14907780E-18 -0.10185571E-18 0.99770362E-03 0.42724865E-02 0.18295912E-18 -0.34728351E-19 -0.44056585E-03 0.12381343E-02 0.14907780E-18 0.10185571E-18 0.20374741E-01 -0.16581098E-38