%chk=000194331.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194331

0 1
O 4.360929 -1.046657 0.000822
N -0.366339 1.802818 -0.000011
C -0.638293 -0.497646 -0.000339
C -1.319889 0.767881 -0.000316
C 0.784530 -0.212608 -0.000045
C 0.925505 1.221036 0.000187
C -1.388527 -1.689095 -0.000491
C -2.729952 0.861111 -0.000514
C 1.929787 -1.012875 0.000114
C -2.780660 -1.589950 -0.000668
C -3.432412 -0.341525 -0.000658
C 2.177250 1.851365 0.000632
C -0.713772 -3.019757 -0.000530
C -3.446246 2.170138 -0.000380
C 3.164871 -0.358951 0.000577
C 3.309826 1.047619 0.000883
H -0.561252 2.783295 -0.000059
H 1.856598 -2.093348 -0.000072
H -3.386758 -2.492943 -0.000820
H -4.522786 -0.323497 -0.000780
H 2.262012 2.934690 0.000901
H -0.074505 -3.137283 -0.888244
H -0.073648 -3.136944 0.886609
H -1.424375 -3.856322 -0.000026
H -2.774762 3.035054 -0.002633
H -4.093885 2.265673 -0.884838
H -4.090320 2.267329 0.886503
H 4.311293 1.473292 0.001314
H 4.224181 -2.023499 0.000583


%chk=000194331-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000194331

0 1
O 4.437213 -1.062554 0.000643
N -0.375140 1.788589 0.000188
C -0.646930 -0.503154 -0.000215
C -1.334961 0.763314 -0.000206
C 0.783854 -0.205719 0.000107
C 0.913429 1.226405 0.000343
C -1.394336 -1.715111 -0.000475
C -2.747259 0.876404 -0.000528
C 1.960647 -1.000219 0.000197
C -2.803110 -1.605643 -0.000758
C -3.458893 -0.344211 -0.000811
C 2.170770 1.866281 0.000704
C -0.714512 -3.070390 -0.000467
C -3.466544 2.215440 -0.000396
C 3.216466 -0.355157 0.000539
C 3.326870 1.062673 0.000801
H -0.576349 2.785063 0.000236
H 1.901794 -2.094526 -0.000026
H -3.408281 -2.519901 -0.000975
H -4.556080 -0.315374 -0.001097
H 2.257322 2.958359 0.000898
H -0.070509 -3.201159 -0.892066
H -0.070263 -3.201033 0.890965
H -1.455618 -3.888206 -0.000307
H -2.774038 3.076312 -0.003168
H -4.117095 2.321200 -0.888870
H -4.112832 2.323418 0.890944
H 4.327517 1.504658 0.001071
H 4.275271 -2.037357 0.000431


