%chk=000189220.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189220

0 1
O -2.505479 0.906585 -0.475909
O 0.244798 2.563366 -1.137194
C -1.815983 -0.123553 0.261550
C -1.170381 -1.346569 -0.425444
C -1.233451 1.252864 0.193792
C 0.340318 -1.135442 -0.597415
C -2.374380 -0.959675 1.395848
C -1.664128 -2.200919 0.790145
C 0.682251 0.219128 -1.278647
C -0.073172 1.452176 -0.783770
C 1.174023 -1.124012 0.699220
C 2.452026 -0.284110 0.395818
C 2.184149 0.401577 -0.977364
C -1.828487 -1.737282 -1.739321
C -1.325964 2.251032 1.301986
C 2.668441 0.773837 1.487988
C 3.688760 -1.190237 0.307997
H 0.733171 -1.952396 -1.252553
H -3.470673 -1.020581 1.411435
H -2.037527 -0.667514 2.396713
H -0.872245 -2.622989 1.414674
H -2.339737 -3.017856 0.515718
H 0.499262 0.155953 -2.377243
H 0.601791 -0.674262 1.529043
H 1.425301 -2.145016 1.023446
H 2.787015 -0.060824 -1.777300
H 2.473474 1.467819 -0.974372
H -2.920446 -1.801016 -1.636594
H -1.640867 -0.988537 -2.519922
H -1.471221 -2.706601 -2.101069
H -0.628715 2.018352 2.115999
H -1.094064 3.266650 0.937353
H -2.342392 2.287680 1.721052
H 2.780543 0.316018 2.475918
H 3.572699 1.363734 1.300609
H 1.830060 1.477435 1.539265
H 3.904048 -1.669447 1.268905
H 3.555211 -1.985552 -0.432691
H 4.581572 -0.622416 0.024236


%chk=000189220-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000189220

0 1
O -2.375365 0.915515 -0.945735
O 0.624083 2.569209 0.194743
C -1.958401 -0.075416 0.078381
C -1.096534 -1.302752 -0.284386
C -1.433652 1.330231 0.208175
C 0.411059 -0.994616 -0.451770
C -2.810892 -0.868714 1.082174
C -1.672507 -1.963525 1.039147
C 0.695019 0.438015 -1.035030
C 0.010365 1.539360 -0.204221
C 1.337068 -1.001174 0.787906
C 2.674657 -0.339308 0.293621
C 2.239411 0.538020 -0.949858
C -1.648265 -2.004868 -1.546096
C -2.028340 2.323894 1.179660
C 3.310763 0.530221 1.406053
C 3.682690 -1.433401 -0.146508
H 0.833330 -1.716060 -1.181606
H -3.760607 -1.224552 0.647260
H -3.015972 -0.388993 2.052534
H -0.984035 -1.881746 1.895936
H -2.008685 -3.008082 0.938759
H 0.311793 0.526689 -2.071482
H 0.895325 -0.391812 1.602901
H 1.504850 -2.017599 1.188829
H 2.689822 0.139276 -1.877400
H 2.561814 1.587001 -0.836932
H -2.740395 -2.161763 -1.484331
H -1.452454 -1.398747 -2.449059
H -1.166622 -2.992025 -1.675156
H -1.499860 2.283827 2.149443
H -1.921685 3.350160 0.790501
H -3.097293 2.108629 1.340891
H 3.510833 -0.071233 2.313980
H 4.272039 0.962332 1.068444
H 2.645238 1.368002 1.681943
H 4.021073 -2.033868 0.719303
H 3.233111 -2.124080 -0.885601
H 4.576819 -0.978645 -0.613512


