1 atom density matrix 2 0.000000 0.000000 0.000000 L, Lx,Ly,Lz in global orthogonal system 0.20013762E-01 -0.62101139E-37 -0.10842022E-18 0.13552527E-18 -0.88472183E-03 -0.12089548E-02 -0.20328791E-18 -0.30493186E-19 0.99349787E-03 -0.49166791E-02 -0.10842022E-18 -0.13552527E-18 0.23077276E-01 0.16940516E-37 0.67762636E-18 -0.28121494E-18 0.18388675E-02 0.23678053E-02 0.20328791E-18 0.30493186E-19 -0.88472183E-03 0.12089548E-02 0.67762636E-18 0.28121494E-18 0.11156961E-01 0.00000000E+00 -0.67762636E-18 0.28121494E-18 -0.88472183E-03 -0.12089548E-02 -0.20328791E-18 0.30493186E-19 0.18388675E-02 -0.23678053E-02 -0.67762636E-18 -0.28121494E-18 0.23077276E-01 -0.16940516E-37 0.10842022E-18 -0.13552527E-18 0.99349787E-03 0.49166791E-02 0.20328791E-18 -0.30493186E-19 -0.88472183E-03 0.12089548E-02 0.10842022E-18 0.13552527E-18 0.20013762E-01 0.62101139E-37