%chk=000214170.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214170

0 1
O 3.393192 -0.570829 -0.422220
O -1.317043 1.034337 0.861885
O -0.551987 0.497567 -1.199943
N -4.678579 -0.169327 -0.181836
C 0.995429 0.698676 0.738528
C 1.378079 -0.734975 0.986681
C 2.040624 1.454830 -0.033022
C -3.238702 -0.314344 0.196226
C 2.523448 -1.288173 0.394679
C 3.152335 0.793868 -0.577216
C -0.323539 0.713737 -0.038790
C -2.694192 1.108739 0.380005
C -5.533574 -1.229792 0.445817
C -4.839325 -0.140868 -1.675451
C 0.599519 -1.562550 1.810736
C 1.935682 2.838697 -0.241675
C 2.902866 -2.626248 0.587731
C 4.140450 1.457763 -1.320724
C 0.960038 -2.893991 2.018668
C 2.907806 3.519777 -0.975521
C -5.690829 -0.959792 1.942911
C -6.172306 0.513133 -2.041090
C 2.105632 -3.423666 1.405277
C 4.002910 2.830088 -1.516805
H 0.830960 1.208693 1.731853
H -2.627632 -0.861060 -0.555958
H -3.128014 -0.876746 1.148115
H -3.191004 1.654814 1.201448
H -2.718160 1.699254 -0.550727
H -6.536594 -1.191154 -0.037661
H -5.140336 -2.255559 0.278537
H -4.007470 0.460815 -2.107798
H -4.766942 -1.150126 -2.135099
H -0.296136 -1.154729 2.284033
H 1.084031 3.382304 0.169037
H 3.797422 -3.010697 0.101922
H 4.980385 0.898177 -1.727250
H 0.349358 -3.527595 2.658894
H 2.814038 4.592581 -1.133792
H -6.022297 0.072632 2.120078
H -4.748777 -1.089474 2.487005
H -6.431548 -1.631906 2.387531
H -7.028270 -0.107553 -1.753627
H -6.235899 0.696668 -3.118555
H -6.289834 1.476690 -1.526594
H 2.375626 -4.467037 1.570674
H 4.752962 3.371051 -2.094313


%chk=000214170-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000214170

0 1
O 3.064111 -0.616819 -0.805243
O -1.318343 1.085337 1.158768
O -0.601758 0.921617 -1.060828
N -4.605570 -0.311243 -0.100355
C 1.050313 0.837856 0.812686
C 1.361045 -0.649569 0.999549
C 2.104419 1.537149 -0.033746
C -3.261010 -0.352356 0.520963
C 2.307975 -1.299508 0.172315
C 3.020314 0.797060 -0.816216
C -0.346158 0.956106 0.160807
C -2.741870 1.088313 0.692247
C -5.548146 -1.329765 0.432279
C -4.540771 -0.281554 -1.589721
C 0.679381 -1.425108 1.968173
C 2.170926 2.949047 -0.096280
C 2.564338 -2.682903 0.287559
C 3.962437 1.429153 -1.654957
C 0.925991 -2.807312 2.102263
C 3.107043 3.602810 -0.923918
C -6.050828 -0.999318 1.850420
C -5.756905 0.411691 -2.231807
C 1.867901 -3.437488 1.252173
C 4.000991 2.836234 -1.711133
H 0.970158 1.319679 1.804051
H -2.532434 -0.938289 -0.085648
H -3.321499 -0.834851 1.512230
H -3.292342 1.622325 1.480634
H -2.801605 1.642035 -0.260232
H -6.418146 -1.364967 -0.248205
H -5.095335 -2.353576 0.419397
H -3.623943 0.266342 -1.876336
H -4.427476 -1.313838 -2.006185
H -0.060599 -0.931034 2.608519
H 1.468396 3.539010 0.505537
H 3.306495 -3.137934 -0.374985
H 4.646801 0.809453 -2.241787
H 0.389032 -3.389628 2.858105
H 3.138481 4.696519 -0.960738
H -6.557918 -0.018810 1.855051
H -5.223383 -0.959039 2.582480
H -6.764373 -1.770192 2.196872
H -6.702446 -0.112871 -2.002793
H -5.647332 0.437373 -3.332023
H -5.844461 1.447548 -1.860195
H 2.063561 -4.511140 1.344812
H 4.728345 3.333158 -2.361957


