%chk=000235321.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235321

0 1
O 0.772448 1.386847 -2.521690
O -0.394439 1.810216 1.376450
O 0.948049 4.126381 -0.758609
O 5.509562 0.475728 0.982928
O -5.338719 -0.957843 -0.795135
O 4.544634 -2.207367 1.203532
O -3.918475 -3.204831 0.256501
C 0.695702 2.736833 -0.551727
C -0.763320 2.347357 -0.953545
C 1.628779 1.890445 -1.470223
C -1.438575 1.902457 0.363220
C 0.775950 2.552507 0.970863
C -0.597348 1.286622 -2.046276
C 2.356588 0.769139 -0.772232
C -2.127367 0.561225 0.322724
C 3.605627 1.048011 -0.189842
C 1.828233 -0.519319 -0.703761
C -3.421275 0.477966 -0.223482
C -1.498331 -0.580011 0.824177
C 4.313546 0.035734 0.464327
C -4.073165 -0.752609 -0.268570
C 2.530079 -1.543929 -0.052654
C -2.145775 -1.817869 0.783894
C 3.765893 -1.278252 0.533655
C -3.431650 -1.919048 0.237757
C 6.346913 -0.481580 1.678546
C -6.093970 0.212822 -1.189320
C 4.030741 -3.558050 1.300652
C -5.268402 -3.433190 -0.219997
H -1.294053 3.237255 -1.356413
H 2.347890 2.536829 -2.028273
H -2.131923 2.693254 0.734220
H 1.624312 1.944174 1.327439
H 0.755908 3.528996 1.491856
H -0.745408 0.250854 -1.689770
H -1.200192 1.468792 -2.948899
H 0.898789 4.362265 -1.709603
H 4.044053 2.044902 -0.237610
H 0.864752 -0.738729 -1.167782
H -3.901860 1.374397 -0.604515
H -0.497759 -0.493743 1.259939
H 2.095413 -2.539624 -0.016233
H -1.668216 -2.714341 1.177742
H 7.204653 0.137219 1.964746
H 6.638016 -1.289645 0.999210
H 5.819684 -0.874787 2.554241
H -5.601664 0.718605 -2.024569
H -6.240660 0.880233 -0.335227
H -7.044862 -0.233918 -1.506965
H 4.829005 -4.058620 1.863076
H 3.918752 -3.995891 0.304534
H 3.090853 -3.568885 1.860159
H -5.982296 -2.864642 0.384382
H -5.379240 -4.513042 -0.070984
H -5.343384 -3.159900 -1.278265


%chk=000235321-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235321

0 1
O 0.971582 -0.517562 -1.783100
O -0.899341 -0.237187 1.430075
O 0.773665 2.485165 0.350855
O 5.735372 1.612018 1.483656
O -6.422959 0.536998 -1.291357
O 6.691111 -1.053970 1.206084
O -6.625747 -2.243435 -0.727226
C 0.575123 1.076491 -0.011934
C -0.793985 0.789861 -0.705068
C 1.628659 0.574693 -1.045526
C -1.738237 0.557276 0.507888
C 0.478952 0.301674 1.329592
C -0.506730 -0.467909 -1.548692
C 2.963753 0.109744 -0.480404
C -3.039168 -0.171822 0.226995
C 3.794402 1.033029 0.202440
C 3.403542 -1.221764 -0.634676
C -4.115839 0.546809 -0.351667
C -3.191877 -1.548065 0.501472
C 5.033491 0.640978 0.745878
C -5.329716 -0.100493 -0.674687
C 4.644233 -1.631091 -0.095357
C -4.412007 -2.192163 0.201280
C 5.463582 -0.717043 0.605842
C -5.487200 -1.492984 -0.384426
C 7.154695 1.839501 1.142273
C -6.269952 1.946781 -1.653992
C 7.110168 -2.456197 1.141895
C -7.940227 -1.752883 -0.263429
H -1.118567 1.645170 -1.323658
H 1.810689 1.420461 -1.753698
H -1.946442 1.550888 0.963976
H 1.167194 -0.556578 1.380664
H 0.680897 1.000268 2.161817
H -0.789496 -1.388507 -1.008552
H -1.005720 -0.456218 -2.532220
H 0.879049 3.020391 -0.478176
H 3.485549 2.073205 0.351495
H 2.768488 -1.926857 -1.176801
H -3.996493 1.617465 -0.552492
H -2.371442 -2.091292 0.977487
H 4.961052 -2.671016 -0.220432
H -4.559733 -3.255679 0.413488
H 7.478659 2.652079 1.810471
H 7.249798 2.161690 0.086614
H 7.754011 0.931040 1.314640
H -5.431381 2.089320 -2.363121
H -6.113193 2.580967 -0.759550
H -7.216915 2.222569 -2.141043
H 8.058581 -2.496777 1.697697
H 7.275970 -2.781723 0.096447
H 6.365696 -3.118562 1.623990
H -7.957455 -1.683526 0.841836
H -8.659688 -2.514877 -0.600176
H -8.175953 -0.771949 -0.706786


