%chk=000272369.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272369

0 1
O -2.725893 -0.375927 -2.005439
O 1.229246 -0.749073 0.445503
O 3.861820 -1.588696 1.524309
O 4.004884 1.134723 -1.407597
O -5.620225 0.329920 1.480923
O -6.976987 0.069165 -0.281714
N -0.143689 0.025268 -1.196225
N -3.490267 -0.541433 0.138118
N 3.396010 -1.064621 -1.184030
N 6.288306 0.881990 0.218573
C -1.385314 1.907919 -0.107768
C -1.219543 0.384851 -0.247343
C -0.143142 2.593432 0.506632
C -2.527443 -0.209208 -0.814057
C -0.372708 4.108926 0.558659
C 0.175969 2.043826 1.900283
C 2.089788 -0.865173 -1.843034
C 1.039953 -0.538431 -0.748831
C 5.289872 -0.206891 0.165180
C -4.796554 -1.094953 -0.267886
C 1.671990 -2.123216 -2.596353
C 4.181574 0.055869 -0.867076
C 4.665690 -0.401114 1.586604
C -5.012070 -2.500342 0.287455
C 3.851705 0.785281 2.073145
C -5.925073 -0.190330 0.243000
H -2.274689 2.123927 0.516772
H -1.598180 2.360132 -1.097782
H -0.969340 -0.063737 0.759291
H 0.735164 2.393552 -0.159176
H -0.337737 0.200649 -2.182956
H -0.579789 4.522818 -0.434068
H 0.513387 4.626934 0.944393
H -1.211025 4.374941 1.211055
H 0.472330 0.984471 1.852150
H 1.011202 2.586880 2.357000
H -0.674541 2.127775 2.582790
H 2.183528 0.010318 -2.550185
H -3.348867 -0.402884 1.137366
H 5.822323 -1.163908 -0.095258
H 3.465188 -1.898869 -0.581020
H -4.854123 -1.109910 -1.401635
H 1.527396 -2.984604 -1.930254
H 0.735625 -1.976054 -3.149504
H 2.440673 -2.412163 -3.329221
H 5.481405 -0.674257 2.298049
H -4.985790 -2.529448 1.384695
H -5.978405 -2.914606 -0.033010
H -4.232457 -3.186908 -0.074048
H 4.467336 1.688435 2.169528
H 3.420011 0.583029 3.062576
H 3.015317 1.025067 1.400431
H 6.824201 0.912498 -0.646584
H 5.825131 1.787375 0.303875
H 2.892201 -1.368450 1.424977
H -6.340174 0.917635 1.838123


%chk=000272369-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000272369

0 1
O -2.648482 -0.459292 -2.014452
O 1.310543 -0.761052 0.664516
O 3.899532 -1.427211 1.595120
O 3.642881 1.175324 -1.426040
O -5.527317 0.119746 1.811147
O -7.268794 -0.348775 0.341765
N -0.154442 -0.145232 -1.026166
N -3.616256 -0.359778 0.097018
N 3.376610 -1.130560 -1.158964
N 6.150468 1.125006 -0.095002
C -1.306864 1.851020 -0.019129
C -1.243262 0.295623 -0.143079
C -0.068360 2.509846 0.643267
C -2.557093 -0.222015 -0.765559
C -0.172760 4.047684 0.505946
C 0.081897 2.098816 2.127528
C 2.010079 -1.142263 -1.687244
C 1.028971 -0.660277 -0.579288
C 5.260092 -0.040137 0.001625
C -4.950077 -0.749518 -0.388486
C 1.623859 -2.555617 -2.178503
C 4.040830 0.067309 -0.941724
C 4.756129 -0.233976 1.489071
C -5.067920 -2.279619 -0.641223
C 4.076201 1.016958 2.066735
C -6.046234 -0.307190 0.575329
H -2.211866 2.119565 0.565120
H -1.448027 2.266482 -1.037259
H -1.066000 -0.152753 0.851349
H 0.836559 2.178046 0.094778
H -0.389894 -0.154926 -2.025811
H -0.246093 4.356437 -0.553544
H 0.716316 4.540343 0.939818
H -1.065071 4.433069 1.037411
H 0.277689 1.017182 2.232383
H 0.933464 2.630486 2.590560
H -0.828805 2.359404 2.703016
H 1.969976 -0.418681 -2.521744
H -3.515676 -0.155272 1.094217
H 5.826687 -0.958248 -0.243881
H 3.648889 -1.900530 -0.532238
H -5.126884 -0.238285 -1.353887
H 1.659250 -3.284586 -1.348044
H 0.602383 -2.566061 -2.596956
H 2.326713 -2.883847 -2.962987
H 5.660274 -0.468172 2.077164
H -4.893712 -2.847345 0.289246
H -6.071015 -2.523373 -1.029625
H -4.312488 -2.570163 -1.388718
H 4.771234 1.873191 2.033159
H 3.797036 0.833829 3.119441
H 3.160953 1.278933 1.504456
H 6.923677 0.990966 -0.754389
H 5.617115 1.973738 -0.328812
H 2.942618 -1.172937 1.408228
H -6.270331 0.371088 2.422743


