TITLE H2CCN, MP2/6-31G* geometry PWFTOL 0.000000000001 ANGSTROM ATOMS C 6 0.000000 0.000000 -1.205722 LIBRARY CscG2ae END C 6 0.000000 0.000000 0.206762 LIBRARY CscG2ae END N 7 0.000000 0.000000 1.353853 LIBRARY NscG2ae END H 1 0.000000 0.936677 -1.741607 LIBRARY HscG2ae END H 1 0.000000 -0.936677 -1.741607 LIBRARY HscG2ae END END MULTIPLICITY 2 UHF DFT KOHNSHAM EM LEBEDEV VFOCK OFF MOBASIS OFF functional QUAD 1 END START FINISH