%chk=000191040.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191040

0 1
O -3.936936 -1.060601 0.256645
O -5.718477 1.435974 0.321187
O -4.111476 1.850889 -1.211044
O 3.688817 -1.299843 1.448286
N 2.507605 -0.014900 0.012725
N 2.364839 -1.637093 1.612995
N 7.437983 0.237103 0.395737
C -4.795149 -0.490416 -0.774045
C -6.141518 -1.094226 -0.397319
C -4.333619 -0.864144 -2.170715
C -4.795190 1.056686 -0.607019
C -2.566463 -0.933756 0.261956
C -1.970276 -1.807345 1.198888
C -1.804835 -0.045335 -0.504416
C 0.195820 -0.894133 0.590099
C -0.592706 -1.779895 1.357785
C -0.420313 -0.031649 -0.333670
C 1.643092 -0.876064 0.760165
C -5.807950 2.861693 0.661815
C 3.733314 -0.290225 0.446767
C -4.672444 3.233511 1.589566
C 5.032807 0.239448 0.087343
C 5.144461 1.242888 -0.892458
C 6.210643 -0.238114 0.710392
C 6.410359 1.732657 -1.216586
C 7.531851 1.207394 -0.553552
H -6.952419 -0.702279 -1.021441
H -6.125990 -2.187950 -0.491576
H -6.392495 -0.864605 0.652110
H -5.142540 -0.772289 -2.906644
H -3.506914 -0.229320 -2.528669
H -3.979089 -1.904393 -2.200039
H -2.599376 -2.480166 1.778902
H -2.268456 0.644075 -1.214085
H -0.113498 -2.448443 2.078943
H 0.190370 0.659601 -0.923339
H -5.806137 3.446469 -0.274877
H -6.800298 2.890513 1.147625
H -4.800924 4.242156 1.999675
H -4.595945 2.535569 2.434555
H -3.704019 3.210610 1.066685
H 4.247031 1.627297 -1.387299
H 6.166384 -1.021870 1.481332
H 6.528171 2.509113 -1.970669
H 8.546709 1.562109 -0.775812


%chk=000191040-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191040

0 1
O -4.135693 -1.339097 0.107590
O -4.978086 1.308309 0.601949
O -4.626175 1.740983 -1.662733
O 3.556326 -1.208033 1.616627
N 2.313058 0.008616 0.147709
N 2.163573 -1.657488 1.770664
N 7.215541 0.658358 0.531108
C -4.972282 -0.602040 -0.888630
C -6.408788 -0.997924 -0.489806
C -4.641384 -1.047831 -2.323561
C -4.816922 0.935672 -0.721004
C -2.751275 -1.151913 0.210032
C -2.125916 -1.998087 1.165715
C -1.972349 -0.219543 -0.524410
C 0.047195 -0.986813 0.654335
C -0.744801 -1.916645 1.386335
C -0.584164 -0.145559 -0.295388
C 1.493004 -0.889075 0.865675
C -4.847424 2.768393 0.922796
C 3.538423 -0.210133 0.621343
C -3.396791 3.105711 1.273392
C 4.793296 0.431499 0.243550
C 4.800085 1.432539 -0.764551
C 6.026745 0.080515 0.860320
C 6.024919 2.034551 -1.110651
C 7.201876 1.619858 -0.441479
H -7.142254 -0.501408 -1.149005
H -6.524184 -2.090379 -0.589001
H -6.605175 -0.708490 0.554155
H -5.299630 -0.526739 -3.038490
H -3.600885 -0.827420 -2.607480
H -4.806885 -2.135217 -2.406882
H -2.749498 -2.705022 1.720624
H -2.419529 0.446932 -1.265499
H -0.266655 -2.569905 2.123273
H 0.027317 0.567416 -0.856870
H -5.205276 3.349936 0.055205
H -5.524135 2.903127 1.781359
H -3.329377 4.163609 1.588381
H -3.033632 2.473089 2.100833
H -2.734374 2.962374 0.403365
H 3.860097 1.713331 -1.249294
H 6.059234 -0.686967 1.640673
H 6.074130 2.808874 -1.881929
H 8.173521 2.064737 -0.683441


