%chk=000220537.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220537

0 1
O 5.396903 1.058171 0.373465
O 5.240077 -1.020882 0.946486
N -3.081278 0.051239 -0.443833
N 4.775655 0.013430 0.492888
C -5.498522 0.191779 0.168267
C -4.041757 0.188786 0.695314
C -1.667710 0.235606 0.004222
C -0.737669 -0.036752 -1.194577
C -5.886831 -1.184041 -0.380465
C -6.449246 0.619000 1.293465
C 0.698477 -0.022750 -0.760130
C 1.461636 1.152974 -0.873449
C 1.284821 -1.186113 -0.229309
C 2.793608 1.170278 -0.466703
C 2.615272 -1.180745 0.180726
C 3.365902 0.000824 0.060062
H -5.579040 0.938358 -0.661320
H -3.861153 1.100751 1.304010
H -3.889980 -0.680388 1.372625
H -1.461240 1.243412 0.424916
H -1.458743 -0.499030 0.814614
H -3.306877 0.739487 -1.170726
H -0.919108 0.704006 -1.999373
H -1.005650 -1.018104 -1.647930
H -5.918305 -1.943352 0.408051
H -6.869919 -1.162847 -0.860035
H -5.155263 -1.527685 -1.124658
H -6.391869 -0.057633 2.153308
H -7.490332 0.612799 0.950213
H -6.230039 1.630031 1.651114
H 1.011102 2.057449 -1.281944
H 0.693615 -2.098446 -0.138686
H 3.398518 2.079825 -0.551552
H 3.083143 -2.081137 0.594148


%chk=000220537-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000220537

0 1
O 5.461064 1.073365 0.422388
O 5.318389 -1.151243 0.906246
N -3.107275 0.226541 -0.407254
N 4.809003 -0.040752 0.484828
C -5.546737 0.190186 0.169893
C -4.097714 0.384896 0.681813
C -1.694921 0.290290 0.008388
C -0.763396 -0.050649 -1.188506
C -5.773136 -1.250978 -0.340289
C -6.560436 0.563594 1.276044
C 0.699283 -0.053410 -0.786977
C 1.470336 1.139616 -0.832890
C 1.315832 -1.242362 -0.311195
C 2.815822 1.156504 -0.419005
C 2.659667 -1.250504 0.107925
C 3.392989 -0.044740 0.048462
H -5.697416 0.888585 -0.683304
H -4.021754 1.379741 1.190009
H -3.881916 -0.383358 1.452434
H -1.395115 1.282288 0.432055
H -1.539287 -0.454624 0.813125
H -3.303240 0.874105 -1.184894
H -0.935857 0.690682 -1.993868
H -1.070499 -1.037287 -1.579231
H -5.726374 -1.969926 0.500903
H -6.764683 -1.354331 -0.818781
H -4.993194 -1.529619 -1.069929
H -6.424804 -0.083283 2.164462
H -7.598716 0.430536 0.921044
H -6.442228 1.614899 1.600065
H 1.010341 2.062483 -1.204726
H 0.734168 -2.170585 -0.275734
H 3.421709 2.065808 -0.452064
H 3.148289 -2.158167 0.471766


