%chk=000235139.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235139

0 1
O 3.512075 0.225854 -0.323384
O 2.744491 2.313230 0.055637
O 3.726491 -2.043832 -0.512920
N 1.823093 -1.064939 0.504918
C 0.066976 0.634425 -0.176601
C -1.187526 0.041278 0.475517
C 1.330121 0.330892 0.635053
C -2.440795 0.352506 -0.354125
C -3.699845 -0.235262 0.296680
C -4.954953 0.074504 -0.531664
C 2.533067 1.144258 0.121969
C 3.062225 -1.114746 -0.164718
C -6.211364 -0.508156 0.110724
H 0.170591 0.262256 -1.216320
H -0.046732 1.737578 -0.270424
H -1.081207 -1.054367 0.593165
H -1.309281 0.444120 1.501141
H 1.168852 0.554324 1.725721
H -2.326858 -0.048314 -1.380300
H -2.555822 1.448229 -0.470442
H -3.820864 0.166411 1.321413
H -3.591647 -1.330739 0.414460
H -5.069383 1.170277 -0.648108
H -4.839416 -0.327844 -1.557332
H 1.152690 -1.825192 0.432724
H -7.102190 -0.282106 -0.486761
H -6.379749 -0.100918 1.114278
H -6.150141 -1.598327 0.205600


%chk=000235139-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000235139

0 1
O 3.587020 0.157862 -0.361473
O 2.754547 2.334248 -0.126852
O 3.734537 -2.213742 -0.302152
N 1.827382 -1.026628 0.483689
C 0.082994 0.700746 -0.190732
C -1.167563 0.030431 0.419251
C 1.382366 0.370023 0.585124
C -2.462296 0.394177 -0.342849
C -3.725851 -0.258498 0.261345
C -5.019624 0.100901 -0.504550
C 2.603049 1.118352 0.017370
C 3.081839 -1.192893 -0.065483
C -6.279148 -0.551186 0.105167
H 0.204931 0.395960 -1.248036
H -0.035648 1.801266 -0.179728
H -1.050952 -1.074095 0.413898
H -1.269769 0.334177 1.482120
H 1.253836 0.671005 1.645135
H -2.361756 0.086505 -1.404138
H -2.585376 1.496917 -0.348305
H -3.831302 0.053029 1.321643
H -3.603129 -1.361918 0.271401
H -5.141331 1.203196 -0.516905
H -4.915241 -0.212176 -1.563375
H 1.269626 -1.828871 0.769708
H -7.189013 -0.279431 -0.460360
H -6.424798 -0.229531 1.153629
H -6.196430 -1.654426 0.101360


