%chk=000221081.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221081

0 1
O -0.513380 2.027003 -1.543050
N 2.149921 -0.017361 -0.562977
N 1.364122 0.749890 -1.411469
N -0.698212 0.042830 -0.321334
N 3.330485 -0.781862 1.182245
N 3.328636 -1.748821 0.227674
C 2.629816 0.290233 0.756377
C 2.625684 -1.338423 -0.852546
C 2.364721 1.557386 1.452045
C 2.384512 -2.051845 -2.114909
C -0.032574 1.011949 -1.074860
C -2.102055 0.077086 -0.009435
C -2.599269 -0.983570 0.775868
C -2.949823 1.105996 -0.446468
C -3.951668 -0.998520 1.117250
C -4.300442 1.068590 -0.091282
C -4.805585 0.023452 0.687212
H 1.855739 1.598107 -1.761021
H 2.805483 1.541550 2.468137
H 2.808578 2.419641 0.929427
H 1.287202 1.751097 1.576334
H 3.124291 -1.761219 -2.881865
H 2.478625 -3.143996 -1.976767
H 1.386887 -1.845800 -2.533984
H -0.188732 -0.789821 -0.006815
H -1.946579 -1.783272 1.118695
H -2.566882 1.929129 -1.058577
H -4.343552 -1.814815 1.724725
H -4.963391 1.866315 -0.428762
H -5.859057 0.003470 0.958231


%chk=000221081-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221081

0 1
O -0.512467 1.991660 -1.884075
N 2.133285 0.000642 -0.446824
N 1.422985 0.935189 -1.195543
N -0.641455 0.238190 -0.288925
N 3.288227 -0.943054 1.230141
N 3.148818 -1.905972 0.161422
C 2.677073 0.190110 0.844712
C 2.458494 -1.320553 -0.831980
C 2.572626 1.462457 1.619397
C 2.084887 -1.927393 -2.144308
C 0.011950 1.103571 -1.155727
C -2.044052 0.159850 -0.033318
C -2.472709 -0.814777 0.907317
C -2.997447 0.997334 -0.669277
C -3.842143 -0.952638 1.210482
C -4.365156 0.845030 -0.353053
C -4.799106 -0.122428 0.581494
H 1.930521 1.559333 -1.826276
H 3.061373 1.317435 2.594780
H 3.070771 2.300048 1.098037
H 1.521052 1.757383 1.789692
H 2.568375 -1.403459 -2.988992
H 2.416462 -2.976837 -2.149563
H 0.993749 -1.898074 -2.317679
H -0.061752 -0.427075 0.229663
H -1.736472 -1.463236 1.400394
H -2.664433 1.745098 -1.391359
H -4.159330 -1.708160 1.937480
H -5.097448 1.493722 -0.846638
H -5.863178 -0.228996 0.816628


