#HF/6-31G* SCF=tight Test Pop=MK iop(6/33=2) iop(6/42=6) remark line goes here 0 1 C 0.3642 4.9928 -4.1851 C -0.9149 5.2970 -3.5460 N -1.9302 5.5384 -3.0388 H 0.5952 3.9265 -4.1045 H 1.1772 5.5530 -3.7139 H 0.3408 5.2561 -5.2467