%chk=000272169.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272169

0 1
O 2.489574 -1.823376 1.487124
O -4.322734 -2.456818 -1.695310
O 0.199649 2.338500 -0.004820
N -2.447329 -1.457459 -1.182913
N 1.485283 0.672577 0.937888
N -3.266136 -2.524110 -1.133155
C -1.172656 -1.552670 -0.502890
C -2.822341 -0.185252 -1.886565
C 0.744316 -0.463055 0.514793
C 1.303333 -1.748313 0.757589
C -0.504707 -0.380129 -0.111151
C -3.647001 0.722047 -1.006639
C -0.606796 -2.819124 -0.256920
C 0.631007 -2.910003 0.381063
C 3.684438 -2.096820 0.696747
C 4.205333 -0.816507 0.102782
C -5.007818 0.446183 -0.804924
C -3.068426 1.849688 -0.408013
C -5.784220 1.300454 -0.018342
C -3.850183 2.702568 0.375557
C 3.853745 -0.447861 -1.203751
C 5.025742 0.026700 0.867115
C -5.208334 2.431575 0.569820
C 1.187394 2.017804 0.629263
C 4.320106 0.755882 -1.739916
C 5.491584 1.228091 0.326356
C 5.138757 1.594526 -0.976705
C 2.199093 2.993035 1.157852
H -3.407217 -0.460727 -2.800172
H -1.903014 0.322976 -2.253873
H -0.953045 0.612178 -0.272862
H -1.130050 -3.730548 -0.549167
H 1.073684 -3.882929 0.595360
H 3.469467 -2.869397 -0.060567
H 4.356077 -2.518329 1.470598
H 2.350995 0.448472 1.453305
H -5.455730 -0.441467 -1.257283
H -1.999244 2.060690 -0.537068
H -6.839510 1.082944 0.137376
H -3.395924 3.578192 0.836717
H 3.210521 -1.094575 -1.800450
H 5.302692 -0.256183 1.882226
H -5.815308 3.097058 1.180001
H 4.044220 1.040335 -2.755087
H 6.137359 1.875372 0.918079
H 5.506275 2.528430 -1.399511
H 3.212982 2.792692 0.778595
H 1.932835 4.016898 0.846175
H 2.244359 2.994991 2.255773


%chk=000272169-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272169

0 1
O 2.452047 -0.982757 1.589117
O -3.674878 -2.048553 -2.946923
O -0.335383 2.996811 0.556345
N -2.181774 -0.908393 -1.684681
N 1.170403 1.315996 1.204604
N -2.614381 -2.124424 -2.222868
C -1.001936 -0.966415 -0.870003
C -2.893729 0.366251 -2.005359
C 0.634247 0.181033 0.546238
C 1.340180 -1.045236 0.716971
C -0.538178 0.212775 -0.240498
C -3.870333 0.835160 -0.930729
C -0.300388 -2.189581 -0.697065
C 0.861829 -2.217095 0.097270
C 3.657307 -1.818638 1.274477
C 4.485345 -1.207179 0.165601
C -5.051102 0.088920 -0.673784
C -3.633621 2.027861 -0.202492
C -5.974055 0.527448 0.300203
C -4.562292 2.467811 0.768380
C 4.298473 -1.597347 -1.185275
C 5.444086 -0.205133 0.466498
C -5.733258 1.719383 1.024135
C 0.701125 2.625542 1.190297
C 5.049888 -0.990541 -2.216635
C 6.198431 0.400490 -0.561684
C 6.000619 0.009283 -1.907196
C 1.532401 3.610818 2.006867
H -3.444460 0.143599 -2.938330
H -2.131565 1.134464 -2.216801
H -1.056117 1.165132 -0.326235
H -0.665586 -3.099768 -1.174592
H 1.381412 -3.169917 0.239326
H 3.338232 -2.848327 1.034254
H 4.199392 -1.828685 2.233587
H 2.019881 1.106997 1.739087
H -5.245069 -0.825674 -1.245933
H -2.724268 2.616003 -0.376025
H -6.882828 -0.055049 0.489927
H -4.365492 3.390738 1.324978
H 3.561815 -2.371094 -1.431510
H 5.599525 0.096559 1.510002
H -6.451831 2.060376 1.778143
H 4.896217 -1.297495 -3.256864
H 6.939854 1.169371 -0.317840
H 6.585663 0.477187 -2.706717
H 2.390785 3.147591 2.522851
H 1.904584 4.407329 1.339399
H 0.881879 4.091579 2.757586


