%chk=000241619.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241619

0 1
O -3.690567 2.971219 0.629051
O -1.593202 3.114882 0.146002
O -5.020105 -3.021671 0.136830
O -6.045831 -1.181942 0.633256
N 0.927402 0.319732 -0.837657
N -0.208188 1.024807 -0.469324
N -2.632750 2.464624 0.306996
N -5.053101 -1.813405 0.308700
C 4.293522 -0.021031 -0.329373
C 3.765029 -0.797023 0.892665
C 5.562158 -0.698149 -0.887338
C 4.843232 -0.909465 1.978488
C 6.642437 -0.809131 0.197618
C 6.120951 -1.560031 1.430572
C 3.218546 0.063127 -1.436933
C 2.061226 0.942048 -1.033615
C 2.310116 2.410869 -0.910096
C -1.380333 0.330878 -0.282941
C -2.577925 1.029542 0.099538
C -1.453796 -1.094612 -0.459138
C -3.778344 0.307734 0.289987
C -2.625139 -1.773270 -0.269889
C -3.806793 -1.066065 0.110360
H 4.561489 1.013790 -0.004381
H 3.435287 -1.808153 0.585621
H 2.866113 -0.300118 1.301610
H 5.954516 -0.128381 -1.749184
H 5.316020 -1.706839 -1.270823
H 5.077014 0.093495 2.383960
H 4.455880 -1.499469 2.830502
H 7.530783 -1.326768 -0.210737
H 6.986306 0.201047 0.491831
H 6.899508 -1.583573 2.215606
H 5.919316 -2.616400 1.167803
H 2.867942 -0.961956 -1.693042
H 3.661720 0.461609 -2.373406
H 2.137042 2.774129 0.115577
H 3.346118 2.685812 -1.160267
H 1.665793 2.999909 -1.581572
H -0.188733 2.064804 -0.331306
H -0.540625 -1.626595 -0.750723
H -4.694700 0.852437 0.584095
H -2.687435 -2.861847 -0.402920


%chk=000241619-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241619

0 1
O -3.653020 3.038678 0.745748
O -1.438465 3.091865 0.214830
O -5.241088 -2.990521 0.010579
O -6.223659 -1.016073 0.611515
N 0.906932 0.161558 -0.879808
N -0.210273 0.907491 -0.486614
N -2.575444 2.443024 0.371465
N -5.203703 -1.716114 0.236580
C 4.355773 -0.023914 -0.343307
C 3.865645 -0.742381 0.939793
C 5.631052 -0.713285 -0.894653
C 4.977546 -0.821350 2.012693
C 6.746769 -0.796877 0.174205
C 6.248720 -1.505312 1.457063
C 3.247802 0.024404 -1.440739
C 2.034187 0.834002 -1.044235
C 2.174614 2.333936 -0.849043
C -1.420010 0.280326 -0.309784
C -2.599111 1.006362 0.110027
C -1.555051 -1.130559 -0.537207
C -3.836337 0.348552 0.287556
C -2.774347 -1.776274 -0.361587
C -3.914347 -1.027929 0.052043
H 4.630351 1.019314 -0.069629
H 3.541014 -1.769516 0.670260
H 2.974186 -0.230736 1.352095
H 5.998389 -0.168748 -1.787798
H 5.367625 -1.738592 -1.230434
H 5.233490 0.203912 2.352341
H 4.605690 -1.367496 2.900964
H 7.626349 -1.326402 -0.240197
H 7.083475 0.228789 0.432118
H 7.047285 -1.512522 2.223640
H 6.018562 -2.565156 1.221815
H 2.924117 -1.005524 -1.678483
H 3.686753 0.462973 -2.361274
H 1.987583 2.631115 0.202449
H 3.188363 2.669822 -1.114728
H 1.456019 2.896477 -1.477411
H -0.206931 1.930263 -0.298614
H -0.661785 -1.671983 -0.853070
H -4.715263 0.915300 0.605037
H -2.881560 -2.850298 -0.534198


