***, file,1,h2co.int,new file,2,h2co.wf,new gthresh,energy=1.d-9 gthresh,orbital=1.d-8 gthresh,civec=1.d-8 geomtyp=zmat geometry O,, 0.000000000, 0.000000000, 0.0196594609 C,, 0.000000000, 0.000000000, 2.3248507925 H1,, 0.000000000, 1.7597110083, 3.3972521023 H2,, 0.000000000, -1.7597110083, 3.3972521023 end basis=6-31G* {hf wf,16,1,0} {multi closed,4,0,1,0 occ,6,2,4,0 wf,16,1,0 state,1 natorb,2140.2,state=1.1 } {nevpt2,thrden=1.0d-10,thrvar=1.0d-10 core,2,0,0,0 closed,4,0,1,0 occ,6,2,4,0 orbit,2140.2,state=1.1 wf,16,1,0 state,1,1 } {multi closed,4,0,1,0 occ,6,2,4,0 wf,16,4,0 state,1 start,2140.2 natorb,2141.2,state=1.4 } {nevpt2,thrden=1.0d-10,thrvar=1.0d-10 core,2,0,0,0 closed,4,0,1,0 occ,6,2,4,0 orbit,2141.2,state=1.4 wf,16,4,0 state,1,1 }