%chk=000185331.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185331

0 1
O -2.220150 -1.659144 0.168687
O 2.313789 -0.731538 0.111126
O -0.949551 2.901095 -0.218942
C -3.685193 -1.330676 0.136842
C -1.282153 -0.693226 0.089750
C -1.610105 0.682405 -0.030885
C -3.971247 0.134432 0.005762
C -4.167952 -2.125471 -1.073846
C -4.173334 -1.898725 1.467108
C -3.007193 1.063529 -0.071158
C 4.659206 -0.835855 0.067606
C 0.046004 -1.143535 0.134302
C -0.536139 1.597822 -0.104840
C 1.063941 -0.184384 0.056160
C 3.478510 0.152639 0.031852
C 0.802839 1.194908 -0.063704
C 4.870697 -1.478748 -1.304716
C 5.919637 -0.111682 0.547764
C 0.057607 3.939815 -0.304825
H -5.026771 0.387424 -0.021993
H -3.778127 -3.151643 -1.050130
H -5.259910 -2.176375 -1.115271
H -3.814916 -1.672027 -2.009035
H -5.265501 -1.940490 1.512931
H -3.784962 -2.913251 1.626546
H -3.822878 -1.287467 2.308777
H -3.225031 2.129461 -0.166109
H 4.398093 -1.644827 0.800758
H 0.274582 -2.200123 0.226898
H 3.457264 0.823984 0.905554
H 3.424508 0.730053 -0.904002
H 1.606243 1.911104 -0.120907
H 5.636390 -2.260913 -1.264911
H 5.183325 -0.750998 -2.060248
H 3.941458 -1.946262 -1.659223
H 6.776463 -0.796412 0.571493
H 5.799219 0.288352 1.560511
H 6.192502 0.719188 -0.111889
H 0.669779 3.799695 -1.200319
H 0.661631 3.956844 0.606888
H -0.560771 4.843323 -0.386062


%chk=000185331-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000185331

0 1
O -2.292350 -1.721039 0.102620
O 2.369492 -0.802271 0.111099
O -0.906581 2.921776 -0.120033
C -3.769789 -1.373858 0.086104
C -1.299539 -0.740273 0.065353
C -1.614098 0.647342 -0.007224
C -4.015430 0.123692 0.005150
C -4.336182 -2.102981 -1.152821
C -4.335438 -1.964027 1.397555
C -3.017276 1.049938 -0.038148
C 4.797630 -0.739971 0.129690
C 0.029267 -1.200419 0.101571
C -0.531256 1.567174 -0.045629
C 1.077814 -0.255793 0.064424
C 3.521270 0.114159 0.071110
C 0.817002 1.137956 -0.011001
C 4.908728 -1.670198 -1.098801
C 6.031340 0.185336 0.255072
C 0.155820 3.924740 -0.173976
H -5.069587 0.425234 -0.016413
H -4.104284 -3.181040 -1.095083
H -5.433539 -1.978735 -1.205322
H -3.891965 -1.693941 -2.075847
H -5.431533 -1.825420 1.441415
H -4.112372 -3.044041 1.452696
H -3.883422 -1.463493 2.270368
H -3.241629 2.118653 -0.095542
H 4.729025 -1.367240 1.040947
H 0.249131 -2.268136 0.159121
H 3.474290 0.806339 0.938211
H 3.494150 0.709079 -0.867656
H 1.634998 1.859080 -0.040208
H 5.796051 -2.324284 -1.016720
H 5.008456 -1.078689 -2.030004
H 4.012370 -2.306792 -1.190071
H 6.957363 -0.413700 0.319760
H 5.977326 0.823467 1.157406
H 6.122663 0.846315 -0.628714
H 0.795429 3.787247 -1.067810
H 0.782771 3.899030 0.738865
H -0.364313 4.892086 -0.237217


