%chk=000222189.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222189

0 1
O -0.644825 0.961225 0.433574
O 0.907899 1.302555 2.042671
N -3.894198 0.161728 -0.021483
C -2.613208 2.308622 0.149704
C -3.147801 1.198650 -0.803804
C -3.118437 -1.114076 0.132311
C -5.176438 -0.246315 -0.687652
C -3.579053 -2.096103 -0.968192
C -4.913188 -1.537025 -1.496374
C -1.652067 1.705479 1.199061
C 1.620338 -1.449647 0.613906
C 1.425827 -0.024367 0.012824
C -3.767475 2.983777 0.904970
C -1.855235 3.347878 -0.694897
C 0.283434 -1.984375 1.170258
C 0.339669 -3.498618 1.395330
C 2.211817 -2.359330 -0.432586
C 0.609164 0.824225 0.974249
C 0.652366 -4.240471 0.087699
C 2.747275 0.642299 -0.290444
C 1.790367 -3.607289 -0.655727
C 3.162551 0.771626 -1.624573
C 3.570396 1.116308 0.742115
C 4.393193 1.365051 -1.919497
C 4.798484 1.709525 0.441259
C 5.213784 1.833153 -0.888730
H -2.289318 0.769216 -1.364710
H -3.806107 1.671355 -1.561551
H -2.018538 -0.942866 0.109586
H -3.361832 -1.512763 1.139668
H -5.907335 -0.437298 0.127000
H -5.595973 0.561629 -1.312493
H -3.698279 -3.114622 -0.566918
H -2.832163 -2.163566 -1.775872
H -4.851801 -1.323108 -2.575635
H -5.733658 -2.260283 -1.367438
H -2.146797 0.962535 1.847101
H -1.149199 2.470282 1.813873
H 2.355263 -1.381768 1.458950
H 0.832209 -0.133584 -0.937687
H -4.457777 3.476422 0.212923
H -3.412565 3.739822 1.610940
H -4.354486 2.242357 1.465767
H -2.484062 3.768337 -1.484779
H -0.971262 2.901934 -1.167228
H -1.504577 4.184178 -0.080477
H -0.549631 -1.735057 0.474152
H 0.042840 -1.475161 2.123817
H 1.114775 -3.735594 2.150734
H -0.618631 -3.854953 1.816035
H 3.046009 -1.932408 -0.990750
H -0.243514 -4.249315 -0.568351
H 0.880014 -5.303121 0.304088
H 2.257063 -4.239174 -1.410619
H 2.530049 0.411214 -2.433703
H 3.238254 1.038191 1.781304
H 4.711911 1.463451 -2.955766
H 5.432176 2.078416 1.246581
H 6.171402 2.294720 -1.120412


%chk=000222189-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222189

0 1
O -0.993028 -0.018828 0.692356
O 0.655603 0.596095 2.231254
N -4.257692 0.482743 -0.519718
C -2.548001 1.949554 0.674512
C -3.175305 1.489234 -0.682394
C -3.963923 -0.871828 -1.070103
C -5.571090 0.831177 -1.125635
C -4.518877 -0.892666 -2.541254
C -5.520920 0.307147 -2.600463
C -2.043730 0.722448 1.464444
C 2.200952 -1.675084 1.058394
C 1.259925 -0.730449 0.227698
C -3.633916 2.622964 1.551154
C -1.390906 2.936046 0.385287
C 1.379569 -2.686882 1.898974
C 2.294902 -3.772202 2.510345
C 3.183668 -2.397368 0.148403
C 0.314851 0.016501 1.172462
C 2.994366 -4.595879 1.403051
C 2.026331 0.293866 -0.620461
C 3.525416 -3.705153 0.294167
C 1.965752 0.232622 -2.035004
C 2.817268 1.303524 -0.012218
C 2.684160 1.154403 -2.830371
C 3.534789 2.225391 -0.805347
C 3.472912 2.154509 -2.217152
H -2.359063 1.089448 -1.319688
H -3.569144 2.393039 -1.192948
H -2.884388 -1.085518 -1.002651
H -4.497402 -1.628915 -0.462241
H -6.372556 0.304711 -0.569774
H -5.764100 1.914470 -1.047758
H -5.013456 -1.854653 -2.765804
H -3.704626 -0.761234 -3.275765
H -5.138965 1.097916 -3.271888
H -6.518537 0.009034 -2.969040
H -2.865412 -0.001650 1.591936
H -1.615547 1.016504 2.438991
H 2.764120 -1.017826 1.755940
H 0.641194 -1.351693 -0.444350
H -4.021151 3.531055 1.051403
H -3.228472 2.926775 2.534624
H -4.479352 1.929966 1.712169
H -1.771149 3.836643 -0.132696
H -0.617004 2.478129 -0.258095
H -0.903045 3.260971 1.322193
H 0.623981 -3.173011 1.247297
H 0.831208 -2.153733 2.697872
H 3.062701 -3.281817 3.141410
H 1.711276 -4.439525 3.172778
H 3.633573 -1.808817 -0.662302
H 2.286376 -5.337446 0.974091
H 3.825144 -5.190025 1.834032
H 4.231695 -4.156146 -0.417784
H 1.355894 -0.542987 -2.514279
H 2.853031 1.374618 1.080947
H 2.628516 1.091727 -3.923139
H 4.140066 3.001221 -0.322813
H 4.030617 2.870787 -2.830947


