%chk=000258114.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258114

0 1
O 0.895309 -2.766619 -0.487110
O 1.762207 2.788092 -0.368171
N 0.643910 -0.593854 0.290429
N -0.353661 1.979561 -0.298385
C 1.501715 0.578129 0.613195
C 2.930657 0.167657 0.183638
C 2.857092 -1.317573 -0.195367
C 1.389749 -1.705578 -0.189929
C -0.765300 -0.406880 0.163371
C 1.026579 1.866419 -0.073310
C -1.265315 0.899183 -0.098698
C -1.654860 -1.482230 0.292839
C -2.648486 1.113589 -0.180045
C -3.029702 -1.255085 0.193830
C -3.522787 0.033380 -0.032128
H 1.457462 0.762512 1.722663
H 3.651509 0.346571 1.000852
H 3.282423 0.788055 -0.665807
H 3.420166 -1.957869 0.511600
H 3.293827 -1.516698 -1.193785
H -0.716227 2.855634 -0.680201
H -1.264189 -2.492147 0.453977
H -3.042559 2.111115 -0.365233
H -3.719672 -2.092616 0.294502
H -4.597548 0.200053 -0.099626


%chk=000258114-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258114

0 1
O 0.939117 -2.848703 -0.479868
O 1.783714 2.906089 -0.264379
N 0.660857 -0.556078 0.078825
N -0.357981 1.992658 -0.229860
C 1.516232 0.584331 0.509285
C 2.934944 0.188386 0.023836
C 2.892811 -1.357855 -0.004833
C 1.411714 -1.719499 -0.181894
C -0.753008 -0.414114 0.066529
C 1.017162 1.926602 -0.043311
C -1.266314 0.911055 -0.060386
C -1.650809 -1.505400 0.147236
C -2.660534 1.134915 -0.070575
C -3.043062 -1.272688 0.121442
C -3.550282 0.043290 0.019381
H 1.490923 0.663737 1.619008
H 3.714207 0.594603 0.685421
H 3.103346 0.601893 -0.984744
H 3.244415 -1.802189 0.946263
H 3.487090 -1.807938 -0.815587
H -0.728066 2.902102 -0.522235
H -1.248300 -2.518428 0.204943
H -3.045373 2.157973 -0.159518
H -3.730097 -2.122780 0.182482
H -4.630408 0.220840 0.005639


