%chk=000219268.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219268

0 1
O 3.047928 -1.310269 -0.572036
O -1.661275 1.991856 -0.645160
O 1.161971 1.448083 -1.501852
O 2.444190 -0.428716 1.430359
N -1.342269 -0.007637 0.481032
C -0.333046 -1.094954 0.588529
C 0.808367 -0.690078 -0.373588
C -2.692880 -0.165858 1.057064
C -3.651057 -1.059899 0.228147
C -0.983318 1.030072 -0.368941
C 0.464574 0.729586 -0.855722
C -3.317460 -2.546498 0.384087
C -3.676504 -0.645898 -1.243943
C 2.157556 -0.754530 0.304930
C 4.459106 -1.382569 -0.171076
C 5.088668 -0.012056 -0.278649
H -0.779654 -2.078251 0.307919
H 0.025710 -1.167379 1.642306
H 0.821671 -1.357785 -1.277830
H -3.135881 0.858517 1.143714
H -2.594011 -0.564821 2.090675
H -4.676240 -0.891040 0.653522
H -3.994217 -3.165991 -0.216948
H -3.412369 -2.876812 1.423809
H -2.293954 -2.772431 0.052982
H -2.767995 -0.950060 -1.774008
H -3.758518 0.445437 -1.353170
H -4.526122 -1.093794 -1.770243
H 4.510257 -1.802042 0.848832
H 4.842130 -2.102616 -0.917656
H 6.179623 -0.059864 -0.179509
H 4.862033 0.461983 -1.244522
H 4.715986 0.666413 0.503944


%chk=000219268-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219268

0 1
O 3.230869 -1.323033 -0.568814
O -1.527987 1.824454 -0.855094
O 1.333009 1.181889 -1.565291
O 2.484587 -0.707622 1.561118
N -1.318184 -0.234200 0.304451
C -0.279063 -1.232370 0.655994
C 0.894489 -0.946428 -0.309744
C -2.631209 -0.195293 0.971951
C -3.764391 -0.994730 0.263938
C -0.880170 0.799224 -0.511538
C 0.572339 0.458945 -0.899241
C -3.508234 -2.520300 0.245888
C -4.039138 -0.458730 -1.159633
C 2.261358 -0.980005 0.357936
C 4.659979 -1.224752 -0.119960
C 5.165219 0.210795 -0.278984
H -0.669326 -2.257197 0.545966
H 0.051716 -1.090408 1.703008
H 0.907168 -1.645714 -1.165863
H -2.925852 0.870292 1.020019
H -2.499950 -0.571073 2.005803
H -4.666620 -0.808321 0.885366
H -4.399478 -3.055304 -0.129704
H -3.278468 -2.913515 1.254579
H -2.668780 -2.773504 -0.428821
H -3.170767 -0.635943 -1.820699
H -4.231536 0.628165 -1.153559
H -4.912838 -0.969309 -1.604678
H 4.720827 -1.567574 0.927900
H 5.183387 -1.928998 -0.785390
H 6.244354 0.252018 -0.041479
H 5.020676 0.564595 -1.313490
H 4.635014 0.894042 0.405062


