%chk=000220619.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220619

0 1
O 4.203997 1.881592 2.078984
N 0.837662 0.470897 -1.182185
N -5.816216 0.146176 -0.074055
N 2.059308 -2.024651 -1.241679
C -1.310140 1.569088 -1.709934
C 0.175838 1.791494 -1.358830
C -2.101609 0.988871 -0.531643
C -3.578929 0.798896 -0.894687
C -4.366992 0.218674 0.291310
C 0.883570 2.591758 -2.460886
C 1.957180 0.272366 -0.400601
C -6.630755 -0.459004 1.025904
C 2.582379 -1.050634 -0.406048
C 2.494245 1.272664 0.417632
C 3.704688 -1.295211 0.438288
C -8.092935 -0.580385 0.564381
C 3.605923 0.975230 1.233613
C 4.217758 -0.273657 1.265524
C 4.279308 -2.613365 0.400919
C -8.982423 -1.117777 1.681281
C 3.749556 -3.566287 -0.426099
C 2.621876 -3.227392 -1.247736
C 3.663707 3.222257 2.152357
H -1.406103 0.910394 -2.595109
H -1.753648 2.536853 -2.018956
H 0.247210 2.358200 -0.390283
H -1.659144 0.021141 -0.219363
H -2.011469 1.655208 0.348578
H -3.672856 0.137588 -1.776987
H -4.030399 1.766412 -1.195964
H -4.272422 0.890826 1.173298
H -3.940836 -0.762992 0.591845
H 0.536075 -0.282816 -1.804774
H 0.816055 2.098013 -3.437266
H 0.454884 3.593399 -2.567563
H 1.952626 2.711323 -2.240322
H -5.927634 -0.408579 -0.929881
H -6.569765 0.218354 1.906591
H -6.251148 -1.448836 1.358875
H 2.055704 2.261930 0.428626
H -8.162600 -1.238113 -0.323323
H -8.457116 0.413585 0.231340
H 5.069926 -0.451475 1.911305
H 5.135203 -2.824293 1.040790
H -8.664061 -2.112511 2.012986
H -8.972952 -0.459550 2.558021
H -10.023840 -1.201361 1.349115
H 4.159333 -4.572145 -0.478897
H 2.190904 -3.978897 -1.916937
H 4.329188 3.691493 2.888773
H 2.632676 3.196552 2.516065
H 3.743315 3.717195 1.180507


%chk=000220619-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000220619

0 1
O 4.638558 1.960803 1.855545
N 0.851792 0.587703 -1.030432
N -5.844963 -0.026238 -0.108680
N 1.794648 -1.937861 -1.018995
C -1.300109 1.654395 -1.577855
C 0.189379 1.885351 -1.224143
C -2.127481 1.013882 -0.441316
C -3.604045 0.787278 -0.833905
C -4.439673 0.174581 0.306853
C 0.902120 2.739647 -2.305767
C 2.009818 0.366597 -0.317082
C -6.731864 -0.576727 0.939424
C 2.512105 -0.999791 -0.302766
C 2.717211 1.362188 0.393817
C 3.710707 -1.314190 0.441685
C -8.175929 -0.733691 0.423323
C 3.895155 1.017043 1.124395
C 4.397350 -0.293094 1.157407
C 4.140126 -2.685161 0.406330
C -9.128870 -1.305120 1.494761
C 3.409423 -3.628129 -0.320732
C 2.235134 -3.212326 -1.024734
C 4.173292 3.347851 1.873839
H -1.356782 1.020162 -2.488593
H -1.745574 2.630712 -1.853020
H 0.227509 2.434769 -0.258413
H -1.666568 0.051263 -0.143100
H -2.082149 1.669619 0.453257
H -3.648257 0.118301 -1.720411
H -4.073031 1.743729 -1.137329
H -4.437971 0.865679 1.174088
H -3.949299 -0.771566 0.655523
H 0.494914 -0.250741 -1.505794
H 0.793090 2.269290 -3.300179
H 0.467826 3.755715 -2.352835
H 1.981791 2.831652 -2.091992
H -5.899156 -0.588585 -0.971211
H -6.724483 0.127295 1.796317
H -6.375361 -1.562843 1.337322
H 2.359434 2.394094 0.382547
H -8.175700 -1.400812 -0.464333
H -8.533093 0.253971 0.075213
H 5.305496 -0.508500 1.727262
H 5.043561 -2.976312 0.954687
H -8.796103 -2.304230 1.834385
H -9.169619 -0.645229 2.381881
H -10.157251 -1.406461 1.103148
H 3.719947 -4.677185 -0.360658
H 1.646091 -3.933691 -1.602651
H 4.901704 3.884083 2.500129
H 3.164603 3.431848 2.323526
H 4.164651 3.787480 0.857165


