%chk=000200602.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200602

0 1
O -4.540878 1.266152 -1.360997
O 6.208215 0.303311 0.218618
C -1.454615 -0.889281 0.468718
C -0.081563 -0.875851 -0.221999
C -2.251963 0.368894 0.037335
C 0.682227 0.394824 0.247558
C -3.680907 0.077710 0.545815
C -1.553880 1.624794 0.556621
C -0.135449 1.675531 -0.038989
C -2.421187 -2.042544 0.145088
C 2.078456 0.481457 -0.425439
C 0.738441 -2.126287 0.126616
C -3.831629 -1.463840 0.409605
C 2.093342 -2.095533 -0.584546
C 2.852655 -0.819213 -0.347756
C 2.884971 1.641558 0.200427
C -4.749796 0.796299 -0.265839
C 4.327524 1.676815 -0.298123
C 4.185759 -0.853035 -0.174026
C 5.024535 0.352672 -0.043840
C -6.101759 0.888651 0.387640
H -1.295464 -0.869656 1.574209
H -0.223736 -0.831401 -1.327625
H -2.294350 0.427004 -1.082244
H 0.832977 0.316542 1.352312
H -3.771282 0.371154 1.615581
H -1.510640 1.632506 1.660534
H -2.117607 2.530455 0.263134
H -0.204753 1.838605 -1.132475
H 0.396554 2.557775 0.365194
H -2.225057 -2.930342 0.764958
H -2.322155 -2.363800 -0.905967
H 1.934313 0.695323 -1.517725
H 0.185261 -3.039875 -0.162744
H 0.888003 -2.197812 1.221574
H -4.515124 -1.731172 -0.414287
H -4.266333 -1.887528 1.329159
H 1.949596 -2.215330 -1.681478
H 2.693000 -2.976852 -0.273954
H 2.880078 1.545455 1.305469
H 2.390175 2.606864 -0.023471
H 4.892148 2.497763 0.188230
H 4.371049 1.896536 -1.384140
H 4.743525 -1.789039 -0.121220
H -6.421422 -0.062336 0.828765
H -6.103926 1.639546 1.188772
H -6.870631 1.196331 -0.337148


%chk=000200602-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000200602

0 1
O -4.738808 1.070308 -1.407859
O 6.266489 0.340474 0.539182
C -1.478335 -0.932826 0.378476
C -0.073838 -0.904735 -0.261482
C -2.295504 0.322714 -0.002882
C 0.675464 0.390479 0.183771
C -3.709483 0.017217 0.541227
C -1.598870 1.604107 0.477299
C -0.164560 1.666432 -0.108286
C -2.436541 -2.084358 -0.008298
C 2.104368 0.496036 -0.457169
C 0.761148 -2.156062 0.083521
C -3.860097 -1.555412 0.371997
C 2.153221 -2.095258 -0.588994
C 2.893066 -0.804802 -0.293885
C 2.886908 1.712136 0.107992
C -4.835883 0.754182 -0.190109
C 4.384687 1.694296 -0.263132
C 4.220180 -0.824175 0.054834
C 5.053368 0.389574 0.167820
C -6.092185 1.063226 0.614050
H -1.349607 -0.938831 1.485663
H -0.203291 -0.867939 -1.368120
H -2.376833 0.364951 -1.110624
H 0.817241 0.318328 1.286609
H -3.765311 0.265169 1.620546
H -1.550827 1.612064 1.586980
H -2.163325 2.505017 0.167795
H -0.230717 1.803836 -1.208696
H 0.350548 2.558079 0.293625
H -2.206361 -3.037275 0.500523
H -2.375299 -2.264902 -1.099295
H 1.951323 0.648415 -1.552475
H 0.234062 -3.071134 -0.247003
H 0.879110 -2.227546 1.184323
H -4.596502 -1.805720 -0.413029
H -4.218468 -2.005922 1.314672
H 2.001952 -2.161403 -1.689164
H 2.772545 -2.964594 -0.301797
H 2.789094 1.709327 1.212958
H 2.434848 2.653066 -0.253152
H 4.929583 2.541502 0.188768
H 4.501268 1.782783 -1.363872
H 4.741983 -1.777933 0.208525
H -6.431654 0.170179 1.171930
H -5.866496 1.843432 1.367611
H -6.896962 1.423296 -0.045472


