%chk=000266391.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266391

0 1
O 1.057489 -2.344123 1.286233
O 2.566676 0.097803 -2.349524
N -1.670694 0.401826 -0.638165
N 2.161742 -1.140449 -0.398426
C -0.190438 -1.514594 -0.653621
C 0.269762 -0.515445 -1.736708
C -1.383510 -0.873017 0.100577
C -0.482142 0.815374 -1.454235
C 1.026157 -1.747513 0.241445
C 1.789828 -0.423609 -1.596696
C -2.566543 -1.824327 0.091606
C 0.413798 1.858534 -0.809205
C -2.463881 1.409836 -0.007500
C 3.511068 -1.196936 0.123227
C -3.601801 -1.727905 -0.845005
C 0.717417 1.829943 0.558334
C -2.587718 -2.848059 1.053955
C 0.955366 2.870164 -1.617405
C -3.219345 1.123251 1.149040
C -2.582575 2.681010 -0.614128
C -4.658759 -2.644134 -0.814012
C 1.555451 2.802449 1.111908
C -3.642992 -3.761221 1.078082
C 1.794259 3.839244 -1.061497
C 3.898679 -2.278318 0.933322
C 4.420997 -0.170866 -0.185701
C -4.076410 2.090753 1.675707
C -3.443183 3.632406 -0.069226
C -4.681672 -3.659930 0.144975
C 2.095279 3.807568 0.304081
C -4.193690 3.347276 1.076207
C 5.203074 -2.324625 1.429449
C 5.721642 -0.239865 0.316763
C 6.117098 -1.311643 1.123502
H -0.492107 -2.492870 -1.102339
H 0.019715 -0.875267 -2.761539
H -1.095228 -0.659609 1.167688
H -0.890693 1.219270 -2.421251
H -3.590779 -0.932334 -1.592387
H 0.299720 1.056123 1.200740
H -1.777337 -2.936352 1.779318
H 0.735542 2.898709 -2.684066
H -3.164115 0.151652 1.633782
H -2.010276 2.930176 -1.503256
H -5.466077 -2.561489 -1.540091
H 1.787476 2.774368 2.176006
H -3.657734 -4.553452 1.825072
H 2.215445 4.619115 -1.694395
H 3.190197 -3.068024 1.190343
H 4.125736 0.666753 -0.821725
H -4.659255 1.858834 2.567268
H -3.529283 4.610279 -0.542912
H -5.505225 -4.371219 0.167899
H 2.748421 4.563680 0.736691
H -4.860646 4.095333 1.494663
H 5.506613 -3.159868 2.060352
H 6.431528 0.551124 0.075538
H 7.132232 -1.356891 1.511843


%chk=000266391-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000266391

0 1
O 1.182343 -1.824292 1.880977
O 2.375580 -0.476144 -2.473740
N -1.472878 0.362793 -0.041624
N 2.144933 -1.128036 -0.190024
C -0.192216 -1.625045 -0.189346
C 0.132123 -0.771502 -1.431855
C -1.462057 -1.026622 0.461979
C -0.511456 0.645670 -1.130658
C 1.079925 -1.541416 0.665853
C 1.660827 -0.755720 -1.487758
C -2.705420 -1.854554 0.093053
C 0.516416 1.739728 -0.789600
C -2.411908 1.315434 0.404210
C 3.529252 -1.058277 0.208307
C -3.509623 -1.530280 -1.024784
C 0.912060 1.994933 0.545157
C -3.020157 -3.005047 0.858253
C 1.095118 2.498578 -1.836698
C -3.308829 1.010125 1.471899
C -2.496971 2.607519 -0.195960
C -4.606502 -2.347593 -1.378646
C 1.874377 2.988139 0.828703
C -4.115801 -3.824318 0.506424
C 2.059496 3.491400 -1.556845
C 4.073765 -2.068448 1.036981
C 4.330163 0.024241 -0.228833
C -4.243938 1.964211 1.919415
C -3.441638 3.549523 0.260028
C -4.911704 -3.498897 -0.616966
C 2.452577 3.739528 -0.220709
C -4.323730 3.242864 1.321017
C 5.427601 -1.991523 1.426645
C 5.684642 0.083619 0.160244
C 6.238913 -0.919964 0.987939
H -0.349563 -2.688488 -0.442416
H -0.267858 -1.178067 -2.372822
H -1.340870 -1.044698 1.565650
H -1.047503 0.969369 -2.048779
H -3.293533 -0.623376 -1.600686
H 0.446375 1.432868 1.362605
H -2.407747 -3.258305 1.733784
H 0.799030 2.305044 -2.875409
H -3.289497 0.025417 1.946644
H -1.815864 2.889380 -1.003491
H -5.227343 -2.081910 -2.241676
H 2.168444 3.178350 1.866600
H -4.351321 -4.709574 1.107884
H 2.499813 4.070432 -2.376154
H 3.445674 -2.893075 1.383119
H 3.901806 0.804860 -0.862581
H -4.919374 1.700255 2.741454
H -3.481325 4.534948 -0.218662
H -5.764635 -4.130446 -0.889297
H 3.195343 4.514173 0.000364
H -5.053435 3.979799 1.672079
H 5.847111 -2.771412 2.071183
H 6.304660 0.919360 -0.181348
H 7.290633 -0.866633 1.289518


