%chk=000236339.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236339

0 1
O -3.551834 -0.431101 -0.352842
O 2.801572 1.519350 -0.310311
O -2.323279 1.454394 -0.134502
O 2.227517 1.082834 1.833782
C -0.002221 -0.475194 0.327325
C 1.042574 -1.581074 0.033623
C -1.248235 -0.713459 -0.570562
C 0.570878 0.933394 0.023731
C -0.411241 -0.556161 1.804918
C 1.664487 -1.516030 -1.366826
C -2.361857 0.259780 -0.323619
C 1.901008 1.160386 0.672372
C 2.567065 -2.718596 -1.633927
C -4.795712 0.321051 -0.186924
C 4.186747 1.774102 0.077772
C -5.143883 1.032454 -1.477629
C 4.907077 0.458453 0.293350
H 0.577040 -2.573521 0.189990
H 1.850108 -1.523854 0.793100
H -1.616855 -1.753872 -0.423526
H -0.962068 -0.661527 -1.644077
H -0.148700 1.714952 0.376771
H 0.642448 1.099635 -1.072871
H 0.445290 -0.339167 2.464408
H -1.182498 0.180347 2.059857
H -0.794087 -1.543945 2.075831
H 2.254461 -0.579934 -1.473618
H 0.871829 -1.466843 -2.138367
H 3.380298 -2.783528 -0.901803
H 3.025507 -2.654863 -2.627404
H 2.011670 -3.662218 -1.589628
H -5.498364 -0.493462 0.066847
H -4.673944 1.016586 0.662468
H 4.553261 2.333693 -0.801675
H 4.188632 2.411998 0.979477
H -4.429808 1.842763 -1.689282
H -5.122674 0.347798 -2.334899
H -6.143590 1.480283 -1.431687
H 4.536823 -0.050810 1.195808
H 4.753578 -0.226503 -0.550573
H 5.985885 0.606108 0.416223


%chk=000236339-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236339

0 1
O -3.598054 -0.423622 -0.337555
O 2.977409 1.496585 -0.269516
O -2.386348 1.564660 -0.244426
O 2.179641 1.179816 1.897801
C -0.000438 -0.408602 0.217056
C 1.023447 -1.549882 -0.088306
C -1.236451 -0.583204 -0.731168
C 0.636879 1.003307 -0.040695
C -0.458362 -0.543494 1.693823
C 1.598705 -1.618075 -1.522933
C -2.416016 0.320950 -0.414917
C 1.962923 1.219645 0.662471
C 2.643910 -2.746518 -1.665563
C -4.856819 0.344374 -0.074484
C 4.345242 1.737137 0.285938
C -5.445300 0.881957 -1.381845
C 5.092587 0.414418 0.481891
H 0.540796 -2.520488 0.151765
H 1.867073 -1.446728 0.625278
H -1.584966 -1.629896 -0.691358
H -0.932883 -0.371675 -1.775304
H -0.077225 1.772047 0.306856
H 0.787216 1.162918 -1.121293
H 0.401590 -0.443864 2.376752
H -1.185505 0.244333 1.962567
H -0.934671 -1.527772 1.862604
H 2.072375 -0.652692 -1.784377
H 0.784240 -1.786996 -2.254999
H 3.494455 -2.584529 -0.976144
H 3.046618 -2.796484 -2.693854
H 2.202815 -3.732686 -1.426109
H -5.516121 -0.396622 0.404957
H -4.626327 1.164195 0.628370
H 4.825249 2.375963 -0.472712
H 4.245469 2.284766 1.239728
H -4.772660 1.629637 -1.834523
H -5.612077 0.064710 -2.104703
H -6.417145 1.369918 -1.181113
H 4.611136 -0.192353 1.266990
H 5.117455 -0.165678 -0.457443
H 6.135042 0.615223 0.791595


