%chk=000299956.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299956

0 1
O 3.286267 1.329521 2.283887
O -4.774806 -1.316685 3.119929
O 7.018922 1.402383 0.123254
O 5.879326 1.054831 -1.775706
O 4.440004 -3.774229 -2.416897
O 6.106771 -3.782388 -0.924227
N -2.281474 3.367672 -0.285081
N -4.199065 -0.462788 -1.603110
N -4.103666 0.592804 1.030865
N 3.630237 0.760099 0.109129
N -5.123639 -2.945324 1.615824
N -5.625835 -4.759507 0.146366
C -3.506517 2.822176 0.348579
C -3.808483 1.368980 0.036630
C -3.761257 0.947523 -1.423144
C 4.972563 0.229696 0.384284
C -1.026483 2.801670 0.012583
C -4.504139 -1.277131 -0.535320
C -4.446115 -0.744631 0.777844
C 5.074242 -1.295981 0.209156
C -2.487507 3.990019 -1.616518
C 1.525748 1.830270 0.719630
C -0.852973 2.006508 1.176256
C 0.107471 3.098121 -0.787388
C 4.685905 -1.786945 -1.186511
C -4.874361 -2.631303 -0.768525
C 2.849244 1.319319 1.146994
C -4.755207 -1.543414 1.933114
C 0.406536 1.545603 1.525845
C 1.362433 2.621082 -0.425754
C -5.189063 -3.440654 0.319542
C 5.948200 0.920368 -0.576003
C 5.193993 -3.174674 -1.429013
H -3.405124 2.953864 1.460060
H -4.381204 3.448667 0.056420
H -2.716532 1.051839 -1.805268
H -4.415516 1.610826 -2.034535
H 5.255390 0.493255 1.455011
H -4.242184 -0.809561 -2.552823
H 4.428258 -1.781853 0.973137
H 6.110802 -1.624088 0.454904
H -3.510664 4.391340 -1.700085
H -2.314820 3.297784 -2.455723
H -1.798760 4.849365 -1.725815
H 3.272649 0.648622 -0.834678
H -1.705130 1.754381 1.810854
H 0.017563 3.716946 -1.674723
H 5.097046 -1.113990 -1.982323
H 3.583162 -1.753043 -1.331454
H -4.922441 -3.019367 -1.776724
H 0.538707 0.952747 2.436101
H 2.227589 2.878130 -1.040433
H -5.378321 -3.529786 2.418158
H -5.624741 -5.403217 0.921722
H -5.508520 -5.189718 -0.759188
H 7.691364 1.860305 -0.452793
H 4.752756 -4.692339 -2.634519


%chk=000299956-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000299956

0 1
O 2.886928 -0.394602 1.757316
O -4.749631 -1.113339 3.404713
O 7.647760 1.031055 0.819734
O 6.229299 2.456612 -0.338471
O 5.956215 -2.363584 -3.398805
O 5.973891 -3.480726 -1.363999
N -2.172257 2.841257 -0.766637
N -5.029522 -0.532174 -1.411507
N -4.267114 0.560918 1.046689
N 4.033065 0.943902 0.256263
N -5.819621 -2.673463 2.052001
N -6.999222 -4.368390 0.897210
C -3.393527 2.603038 0.036137
C -3.927338 1.181585 -0.056216
C -3.993953 0.521110 -1.438921
C 5.320404 0.401158 0.697945
C -0.948931 2.273411 -0.387748
C -5.296545 -1.257995 -0.260163
C -4.841616 -0.722977 0.981983
C 5.627402 -1.011619 0.111424
C -2.231601 3.740792 -1.926671
C 1.579032 1.133556 0.386467
C -0.837264 1.439716 0.774545
C 0.237341 2.507789 -1.155245
C 5.662211 -1.019084 -1.425749
C -6.046551 -2.471909 -0.328342
C 2.851058 0.505631 0.852374
C -5.085013 -1.431627 2.225016
C 0.398732 0.888749 1.138990
C 1.468058 1.949555 -0.770344
C -6.295987 -3.173892 0.857487
C 6.400466 1.410385 0.331085
C 5.874998 -2.406557 -1.994739
H -3.226022 2.824438 1.107381
H -4.163964 3.311590 -0.324841
H -2.992476 0.105683 -1.699679
H -4.247233 1.268869 -2.214547
H 5.302454 0.284129 1.800404
H -5.400435 -0.869309 -2.299433
H 4.839875 -1.690001 0.479835
H 6.588199 -1.365301 0.523874
H -3.258021 4.125571 -2.037483
H -1.957111 3.225424 -2.870389
H -1.553591 4.610238 -1.807306
H 4.063963 1.787661 -0.321752
H -1.714655 1.215657 1.386537
H 0.200111 3.123741 -2.057608
H 6.460830 -0.366296 -1.829899
H 4.712348 -0.624279 -1.835869
H -6.396901 -2.872362 -1.283608
H 0.478696 0.247959 2.023378
H 2.338046 2.142488 -1.410511
H -5.983700 -3.161505 2.938010
H -7.136405 -4.883825 1.762109
H -7.364320 -4.767558 0.037898
H 8.327868 1.711499 0.563912
H 6.089879 -3.288693 -3.742438


