%chk=000247817.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247817

0 1
O 0.059493 -3.720011 0.986365
O -0.396122 0.107036 0.844985
O -4.150314 -1.724076 -1.159816
O 4.082212 -1.018695 1.844332
O 1.281436 -1.118297 -1.842419
N -2.093767 -1.109323 -0.222599
N 2.613739 -1.410444 0.061898
C -1.359537 -2.364506 -0.490146
C 2.170569 -2.768291 0.439996
C -1.279002 -3.251835 0.763247
C 1.011009 -2.734691 1.451382
C -2.626528 1.060658 0.443520
C -3.783651 0.500824 -0.167733
C 3.619938 0.693703 0.134633
C 2.759006 0.662360 -0.998229
C -1.522892 0.039347 0.421166
C -3.469820 -0.901119 -0.608646
C 3.531731 -0.625289 0.850466
C 2.080343 -0.677612 -1.055259
C -2.632940 2.344451 0.942732
C -4.951180 1.222621 -0.283008
C 4.369232 1.811046 0.431751
C 2.644136 1.748020 -1.838582
C -3.831600 3.089378 0.826286
C -4.960999 2.542898 0.228994
C 4.253538 2.928418 -0.429757
C 3.412985 2.897617 -1.536234
H -0.328688 -2.120969 -0.860728
H -1.869335 -2.901397 -1.323826
H 3.041763 -3.321457 0.859293
H 1.841815 -3.316595 -0.477936
H -1.819084 -4.209695 0.626091
H -1.657008 -2.748740 1.669574
H 0.557107 -1.730282 1.547967
H 1.319970 -3.097028 2.447925
H -1.748850 2.776811 1.412814
H -5.839979 0.797386 -0.751297
H 5.029482 1.839101 1.299361
H 1.985599 1.727494 -2.707475
H -3.858722 4.108454 1.215559
H -5.875836 3.132442 0.148290
H 4.838081 3.823681 -0.212868
H 3.337569 3.768609 -2.188768


%chk=000247817-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247817

0 1
O 0.092144 -2.785466 1.298930
O -2.043836 1.251643 1.412123
O -4.117367 -2.127577 -1.132635
O 4.934291 -2.423333 0.395274
O 1.677834 0.630454 -1.100826
N -2.777010 -0.607353 0.119103
N 3.059989 -1.128042 -0.297976
C -1.497044 -1.322470 0.028805
C 1.995773 -2.118191 -0.094763
C -1.177977 -2.056016 1.358632
C 1.285632 -1.926979 1.267800
C -4.396197 0.990356 0.625017
C -5.020304 -0.028011 -0.136546
C 5.130002 -0.065097 -0.393702
C 4.151745 0.856029 -0.844417
C -2.951495 0.632806 0.802458
C -3.993610 -1.066846 -0.472841
C 4.446016 -1.351171 -0.037309
C 2.812983 0.187328 -0.790157
C -5.113914 2.104481 1.084076
C -6.382532 0.033735 -0.464724
C 6.487662 0.280983 -0.333732
C 4.499002 2.153378 -1.248693
C -6.493678 2.176702 0.757846
C -7.118280 1.157284 -0.004623
C 6.849849 1.592114 -0.740713
C 5.870889 2.513815 -1.190665
H -0.704478 -0.590946 -0.214384
H -1.583614 -2.053820 -0.793316
H 2.443127 -3.124091 -0.153665
H 1.258297 -2.004616 -0.907546
H -1.938289 -2.829574 1.557182
H -1.169135 -1.326534 2.194224
H 1.015904 -0.862014 1.411554
H 1.947643 -2.245317 2.093465
H -4.620810 2.885910 1.670618
H -6.853240 -0.758906 -1.054578
H 7.234420 -0.438976 0.015281
H 3.734866 2.856544 -1.594246
H -7.086814 3.031986 1.098799
H -8.184435 1.240495 -0.241103
H 7.900739 1.898697 -0.707185
H 6.180149 3.518609 -1.497544


