%chk=000182796.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182796

0 1
O 8.241966 -1.234762 0.978314
N 4.778575 -0.490532 -0.148277
N 1.982937 0.223126 -0.367089
N 0.617748 -0.101091 -0.635909
N -2.291288 2.878555 0.315625
C 3.977254 -0.110271 1.062051
C 4.258330 0.249643 -1.345302
C 2.506724 -0.511490 0.842115
C 2.789590 -0.145454 -1.586825
C 6.235099 -0.221145 0.063698
C -0.322525 0.895352 -0.245847
C 6.837216 -1.443005 0.782646
C -1.727019 0.498896 -0.143758
C -2.678527 1.539580 0.141068
C 0.019782 2.216552 -0.064619
C -2.190301 -0.812275 -0.309464
C -3.553341 -1.122869 -0.196422
C -4.496201 -0.081857 0.091158
C -4.045936 1.232844 0.254823
C -1.006974 3.177779 0.210597
C -4.038726 -2.473962 -0.365042
C -5.897056 -0.424673 0.203529
C -5.366615 -2.755540 -0.251476
C -6.313184 -1.710810 0.038676
H 4.378602 -0.661566 1.939678
H 4.038548 0.975323 1.299413
H 4.339094 1.354166 -1.241328
H 4.860809 -0.045847 -2.231445
H 2.429838 -1.616590 0.749075
H 1.903627 -0.202620 1.723442
H 2.381113 0.425212 -2.450828
H 2.720960 -1.224795 -1.842312
H 6.446498 0.701113 0.646569
H 6.743306 -0.083866 -0.914496
H 0.335529 -1.068791 -0.414921
H 6.665670 -2.378385 0.222719
H 6.458429 -1.555686 1.815140
H -1.488231 -1.614951 -0.538900
H 1.055294 2.546301 -0.131102
H -4.748506 2.040914 0.471019
H -0.726107 4.230998 0.348063
H 8.718856 -1.266223 0.127145
H -3.313227 -3.255113 -0.586201
H -6.601635 0.377074 0.422522
H -5.743703 -3.769157 -0.376852
H -7.365391 -1.980205 0.120828


%chk=000182796-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000182796

0 1
O 8.489785 -1.132479 0.597570
N 4.822300 -0.458574 -0.159984
N 2.003595 0.137503 0.013850
N 0.616331 -0.167188 0.013163
N -2.360769 2.919528 0.181848
C 4.189197 -0.114483 1.138316
C 4.117983 0.233198 -1.267820
C 2.709468 -0.532154 1.142264
C 2.637673 -0.183317 -1.297807
C 6.289073 -0.239108 -0.164529
C -0.347348 0.834201 0.067647
C 7.043551 -1.392605 0.531336
C -1.763352 0.478608 0.002652
C -2.729124 1.575711 0.061984
C -0.006440 2.191104 0.187969
C -2.239147 -0.847635 -0.115363
C -3.625486 -1.143162 -0.182834
C -4.587377 -0.049094 -0.126949
C -4.110503 1.278403 -0.004587
C -1.040673 3.173948 0.240927
C -4.114713 -2.492108 -0.305872
C -5.993606 -0.357595 -0.197672
C -5.480621 -2.753010 -0.371787
C -6.430332 -1.673558 -0.317201
H 4.710822 -0.643027 1.955331
H 4.255894 0.983419 1.343592
H 4.174802 1.346121 -1.167800
H 4.590376 -0.048970 -2.226456
H 2.645813 -1.644258 1.055386
H 2.225035 -0.221392 2.083415
H 2.098935 0.371942 -2.084729
H 2.572560 -1.276389 -1.518881
H 6.581671 0.724287 0.319421
H 6.623551 -0.184033 -1.219955
H 0.339161 -1.145724 -0.128606
H 6.817722 -2.347759 0.014650
H 6.740248 -1.487976 1.586786
H -1.546928 -1.699170 -0.155418
H 1.045027 2.480580 0.240358
H -4.806118 2.123018 0.042113
H -0.760967 4.231104 0.336376
H 8.859407 -1.119290 -0.321300
H -3.391362 -3.315898 -0.347780
H -6.714816 0.466992 -0.155620
H -5.841810 -3.783030 -0.465877
H -7.501585 -1.896782 -0.370626


