1 2 atom density matrix, multiplicity 2 0.000000 0.000000 0.000000 L, Lx,Ly,Lz in global orthogonal system 0.67296610E+00 -0.15347522E-35 -0.45293670E-17 0.35460190E-17 -0.11612054E-01 -0.37056426E-01 -0.74137989E-17 0.82433750E-19 0.56674798E-01 -0.15460249E+00 -0.45293670E-17 -0.35460190E-17 0.76093698E+00 -0.94200007E-35 0.23448374E-16 -0.89596718E-17 0.53987406E-01 0.78651076E-01 0.74137989E-17 -0.82433750E-19 -0.11612054E-01 0.37056426E-01 0.23448374E-16 0.89596718E-17 0.38172546E+00 0.00000000E+00 -0.23448374E-16 0.89596718E-17 -0.11612054E-01 -0.37056426E-01 -0.74137989E-17 -0.82433750E-19 0.53987406E-01 -0.78651076E-01 -0.23448374E-16 -0.89596718E-17 0.76093698E+00 0.94200007E-35 0.45293670E-17 -0.35460190E-17 0.56674798E-01 0.15460249E+00 0.74137989E-17 0.82433750E-19 -0.11612054E-01 0.37056426E-01 0.45293670E-17 0.35460190E-17 0.67296610E+00 0.15347522E-35