%chk=000222113.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222113

0 1
O 1.178167 2.432263 -0.012573
O 0.370525 -1.826064 1.626264
N 0.483975 0.423536 0.974386
N -4.027001 -2.454238 -0.245983
C -0.825441 0.874256 1.504521
C -1.946386 0.536858 0.545911
C 2.496082 0.361771 -0.204105
C 2.249131 -0.945527 0.301625
C 1.362665 1.262094 0.201810
C 0.945812 -0.938831 1.051728
C -2.504079 1.501004 -0.314789
C -2.423253 -0.778787 0.541197
C 3.628847 0.642707 -0.935987
C 3.134715 -1.976757 0.078153
C -3.557456 1.118775 -1.164895
C -3.478039 -1.145575 -0.313970
C -2.016641 2.912554 -0.344377
C -4.046055 -0.183912 -1.176384
C 4.540289 -0.415513 -1.168975
C 4.299620 -1.691811 -0.674624
H -0.765618 1.970345 1.703705
H -0.996147 0.375296 2.489663
H -1.971886 -1.517247 1.207186
H 3.821568 1.643283 -1.325163
H 2.950061 -2.979606 0.465038
H -4.001672 1.858491 -1.831159
H -2.337470 3.465021 0.549234
H -0.913853 2.966941 -0.387219
H -2.387254 3.467986 -1.214903
H -4.867498 -0.452566 -1.834548
H 5.443592 -0.215201 -1.747469
H 5.013968 -2.494564 -0.864294
H -3.414801 -3.163935 0.133571
H -4.492971 -2.776344 -1.082172


%chk=000222113-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222113

0 1
O 1.158228 2.343547 -0.332683
O 0.519437 -1.795231 1.828082
N 0.518311 0.380862 0.857313
N -3.938656 -2.482982 -0.503707
C -0.781014 0.852065 1.393624
C -1.969097 0.553093 0.477788
C 2.550796 0.280716 -0.279216
C 2.363971 -0.960361 0.375975
C 1.375301 1.159050 0.027046
C 1.059940 -0.912462 1.113704
C -2.620099 1.584986 -0.262151
C -2.417364 -0.786323 0.398820
C 3.691877 0.536624 -1.052866
C 3.313188 -1.988571 0.280000
C -3.712916 1.201572 -1.082514
C -3.510687 -1.153777 -0.430629
C -2.198795 3.045548 -0.189225
C -4.158008 -0.130800 -1.179042
C 4.658296 -0.498108 -1.158708
C 4.471982 -1.741116 -0.502155
H -0.675801 1.934244 1.572130
H -0.910541 0.340515 2.364344
H -1.904013 -1.553819 0.992501
H 3.824964 1.500741 -1.553440
H 3.159538 -2.943522 0.792219
H -4.231257 1.974541 -1.663458
H -2.392293 3.482340 0.810914
H -1.122784 3.178224 -0.403572
H -2.768127 3.645729 -0.920090
H -5.006344 -0.380755 -1.828574
H 5.562187 -0.336223 -1.755699
H 5.234971 -2.520638 -0.601567
H -3.469980 -3.209184 0.029288
H -4.729715 -2.743825 -1.084048


