%chk=000245780.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245780

0 1
O 1.932336 -1.562615 1.049411
O -0.612794 1.028330 -1.486215
O 2.563795 2.160045 0.697824
O 4.162051 1.059014 -0.411487
N -1.724330 0.983061 0.509004
C 0.622864 0.258724 0.447963
C 1.873919 0.204025 -0.482587
C 0.504221 -1.238834 0.907874
C 2.310562 -1.301131 -0.350665
C 0.146005 -2.087922 -0.316882
C 1.248983 -2.126328 -1.084271
C -0.605994 0.771774 -0.292411
C 2.997520 1.121205 -0.094455
C -3.016070 1.396700 -0.086866
C -4.093281 0.285286 -0.051716
C -4.481728 -0.083063 1.383800
C -3.645730 -0.948954 -0.838189
H 0.835011 0.906854 1.333306
H 1.578627 0.452696 -1.541646
H 0.006393 -1.435444 1.856242
H 3.369463 -1.534315 -0.480940
H -0.820875 -2.525054 -0.463099
H 1.429316 -2.600235 -2.028498
H -1.753383 0.688881 1.477426
H -2.839135 1.712181 -1.145712
H -3.377610 2.296606 0.458925
H -5.000115 0.710734 -0.557285
H 3.300797 2.786184 0.937785
H -5.339626 -0.766709 1.392858
H -4.765218 0.800100 1.966229
H -3.670117 -0.588814 1.915630
H -2.803970 -1.457427 -0.356647
H -3.319473 -0.679685 -1.851367
H -4.458611 -1.676569 -0.934539


%chk=000245780-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245780

0 1
O 1.979811 -1.613675 1.099208
O -0.652880 0.757467 -1.623660
O 2.436892 2.296072 0.683322
O 4.199527 1.059869 -0.173929
N -1.728785 0.955147 0.434647
C 0.596548 0.169969 0.419382
C 1.905597 0.197370 -0.427777
C 0.531753 -1.372420 0.828574
C 2.415649 -1.297121 -0.301381
C 0.294393 -2.202677 -0.437774
C 1.463037 -2.158321 -1.132705
C -0.632123 0.659819 -0.357779
C 2.970664 1.175228 0.027521
C -3.019719 1.403525 -0.116554
C -4.154475 0.345476 -0.009989
C -4.493009 0.009166 1.462242
C -3.815927 -0.930056 -0.813914
H 0.724637 0.758288 1.342942
H 1.646425 0.444874 -1.477402
H -0.064133 -1.600127 1.721563
H 3.497722 -1.431803 -0.407631
H -0.656840 -2.646294 -0.735155
H 1.680785 -2.554250 -2.125597
H -1.625886 0.892466 1.449175
H -2.831955 1.647497 -1.176827
H -3.328671 2.330967 0.404819
H -5.047772 0.820929 -0.467464
H 3.180838 2.917878 0.911665
H -5.370301 -0.660279 1.521357
H -4.724283 0.920163 2.046833
H -3.650091 -0.514377 1.954423
H -2.918596 -1.423459 -0.395240
H -3.604063 -0.694489 -1.872041
H -4.650967 -1.653521 -0.776052


