%chk=000252536.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252536

0 1
S 0.657932 -0.482621 0.449550
O 3.870864 1.646716 -1.212625
O 0.938726 -0.749220 1.851353
O 1.094555 -1.441876 -0.554470
N 1.418926 1.029366 0.087435
N -5.065058 0.689559 -0.396056
C 2.641107 1.344386 0.864653
C 3.949267 1.033202 0.095741
C -1.002257 -0.146157 0.212587
C 4.167191 -0.441175 -0.188484
C -1.673925 -0.679758 -0.898648
C -1.703871 0.647960 1.131724
C -3.023134 -0.429244 -1.102471
C -3.054453 0.916640 0.955001
C -3.726437 0.380752 -0.173432
H 2.602767 2.430792 1.111402
H 2.637152 0.810791 1.846984
H 4.818248 1.475676 0.633323
H 1.590310 1.223615 -0.916571
H 5.087919 -0.598447 -0.764481
H 3.352619 -0.872341 -0.799339
H 4.227855 -1.033128 0.731286
H -1.124424 -1.309591 -1.611895
H -1.183808 1.057451 2.005395
H -3.532071 -0.844151 -1.967170
H -3.587157 1.535496 1.670333
H 3.846621 2.617875 -1.136541
H -5.588835 0.183995 -1.089646
H -5.610928 1.114635 0.333462


%chk=000252536-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000252536

0 1
S 0.706852 -0.516178 0.313012
O 4.104193 1.574815 -1.284929
O 1.053179 -0.737897 1.894913
O 1.074734 -1.648573 -0.809476
N 1.500991 1.146334 -0.128906
N -5.215724 0.614595 -0.238544
C 2.671190 1.476086 0.723986
C 4.033445 1.064701 0.112097
C -1.110336 -0.149021 0.143379
C 4.259199 -0.445766 0.019969
C -1.773014 -0.591685 -1.015137
C -1.769045 0.532094 1.182883
C -3.149499 -0.336004 -1.140923
C -3.144908 0.784887 1.053423
C -3.855061 0.360401 -0.112596
H 2.642628 2.574898 0.874240
H 2.523594 1.000139 1.713881
H 4.838364 1.529988 0.722124
H 1.790454 1.060757 -1.127220
H 5.256481 -0.649440 -0.404876
H 3.505064 -0.928251 -0.627137
H 4.193489 -0.907287 1.021194
H -1.222109 -1.143553 -1.783619
H -1.220406 0.838640 2.078933
H -3.685797 -0.677249 -2.033779
H -3.678625 1.309987 1.853918
H 4.153470 2.565496 -1.266439
H -5.730368 0.308591 -1.059355
H -5.726734 1.099693 0.493383


