1 atom density matrix 2 0.000000 0.000000 0.000000 L, Lx,Ly,Lz in global orthogonal system 0.20013883E-01 -0.67557530E-37 -0.10842022E-18 0.13552527E-18 -0.88875595E-03 -0.12066116E-02 -0.20328791E-18 -0.30493186E-19 0.99366471E-03 -0.49168701E-02 -0.10842022E-18 -0.13552527E-18 0.23076914E-01 0.16985858E-37 0.67762636E-18 -0.28121494E-18 0.18390575E-02 0.23677762E-02 0.20328791E-18 0.30493186E-19 -0.88875595E-03 0.12066116E-02 0.67762636E-18 0.28121494E-18 0.11156138E-01 0.00000000E+00 -0.67762636E-18 0.28121494E-18 -0.88875595E-03 -0.12066116E-02 -0.20328791E-18 0.30493186E-19 0.18390575E-02 -0.23677762E-02 -0.67762636E-18 -0.28121494E-18 0.23076914E-01 -0.16985858E-37 0.10842022E-18 -0.13552527E-18 0.99366471E-03 0.49168701E-02 0.20328791E-18 -0.30493186E-19 -0.88875595E-03 0.12066116E-02 0.10842022E-18 0.13552527E-18 0.20013883E-01 0.67557530E-37