%chk=000210627.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210627

0 1
O -0.181010 3.682948 1.109020
O -2.501842 1.279821 0.482217
O -1.370551 2.330556 -1.180214
N 2.332561 -0.007589 1.429805
N 1.199606 0.595129 1.909414
N -4.326950 -0.901563 -1.886832
C 1.624659 1.399989 -0.181009
C 2.622087 0.462804 0.150768
C 1.813781 1.941277 -1.549127
C 3.605147 0.241768 -0.940988
C 3.054290 1.156578 -2.083939
C 0.753067 1.457228 0.936490
C -0.468753 2.292978 1.127070
C 3.041206 -0.982585 2.219605
C -1.457454 1.998262 -0.022533
C 4.397822 -1.232659 1.951215
C 2.368910 -1.672045 3.245072
C -3.103232 -0.279452 -1.296245
C -3.584100 0.886242 -0.421301
C -4.810707 -2.053728 -1.056875
C -4.151228 -1.243289 -3.327371
C 5.073430 -2.192104 2.709264
C 3.065007 -2.622535 3.993006
C 4.412719 -2.888136 3.726079
C -6.270799 -2.364011 -1.389386
C -3.088380 -2.297442 -3.648940
H 2.000340 3.029907 -1.545217
H 0.916708 1.782199 -2.180501
H 3.651740 -0.815707 -1.257662
H 4.628841 0.540847 -0.651220
H 3.833933 1.855483 -2.424052
H 2.769440 0.544700 -2.954660
H -0.948902 2.140778 2.130485
H 4.926609 -0.682761 1.175228
H 1.318141 -1.457033 3.456885
H -2.486163 -0.978825 -0.693084
H -2.427497 0.115523 -2.088440
H -3.895937 1.760675 -1.015747
H -4.373079 0.602851 0.297795
H 0.321411 3.925685 0.291660
H -4.188179 -2.965912 -1.184699
H -4.734716 -1.764517 0.015488
H -3.919945 -0.295523 -3.864857
H -5.142075 -1.579047 -3.708916
H 6.125421 -2.393332 2.506633
H 2.551457 -3.160064 4.790824
H 4.947282 -3.633454 4.312880
H -6.700521 -3.055845 -0.657737
H -6.378723 -2.815966 -2.381477
H -6.878662 -1.448922 -1.383841
H -3.030867 -2.478081 -4.727911
H -3.310710 -3.257164 -3.169119
H -2.091433 -1.988437 -3.317105


%chk=000210627-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000210627

0 1
O 0.008124 3.913731 1.025677
O -2.368044 1.206743 0.750883
O -1.688782 2.772109 -0.846178
N 2.263567 0.008285 1.379443
N 1.172901 0.704324 1.940628
N -4.113952 -0.955828 -1.818824
C 1.558551 1.422866 -0.217372
C 2.496342 0.435069 0.076611
C 1.784329 2.001935 -1.594803
C 3.470765 0.181262 -1.047474
C 2.768628 0.949541 -2.231015
C 0.760820 1.564776 0.959619
C -0.385313 2.516180 1.220451
C 2.934048 -0.980511 2.165866
C -1.544303 2.192854 0.262349
C 4.148663 -1.556506 1.716176
C 2.376593 -1.375576 3.407567
C -2.961893 -0.336010 -1.126084
C -3.477487 0.736270 -0.146257
C -4.660946 -2.132406 -1.096217
C -3.942756 -1.117114 -3.284135
C 4.792318 -2.534256 2.504329
C 3.033099 -2.350233 4.185727
C 4.240907 -2.938682 3.740830
C -6.070122 -2.537229 -1.566103
C -2.908042 -2.183866 -3.735987
H 2.253119 3.003710 -1.530002
H 0.860872 2.116032 -2.189814
H 3.617947 -0.886944 -1.289673
H 4.467636 0.611703 -0.822832
H 3.503369 1.418877 -2.907921
H 2.183141 0.224087 -2.824605
H -0.717098 2.407640 2.264620
H 4.601287 -1.242370 0.772783
H 1.446353 -0.908018 3.737248
H -2.345186 -1.074425 -0.564462
H -2.299006 0.148594 -1.865115
H -3.894969 1.598057 -0.692613
H -4.220934 0.324090 0.552629
H -0.187524 4.144811 0.075983
H -3.977724 -3.016253 -1.160698
H -4.712327 -1.863880 -0.023545
H -3.653961 -0.129975 -3.692075
H -4.929204 -1.353857 -3.723438
H 5.731635 -2.974476 2.151655
H 2.597762 -2.651509 5.144884
H 4.745300 -3.696157 4.349969
H -6.471135 -3.336357 -0.916119
H -6.069426 -2.922323 -2.601652
H -6.752997 -1.670476 -1.520511
H -2.833303 -2.199625 -4.839292
H -3.195756 -3.198137 -3.404073
H -1.902684 -1.964045 -3.331142


