%chk=000221920.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221920

0 1
O -2.029996 -0.700488 0.619297
O 2.911977 -0.017799 1.717511
O 4.020128 0.170636 -0.373004
O -2.708525 -2.101079 -1.025022
C -2.185937 1.640065 0.196478
C -1.619998 0.313667 -0.367232
C -0.110811 0.270224 -0.414474
C -3.716268 1.595408 0.197886
C -1.670950 2.822196 -0.627417
C 0.607174 0.130821 0.802409
C 0.543498 0.371722 -1.642657
C 1.977513 0.107866 0.696050
C 2.644602 0.219849 -0.560872
C 1.954177 0.352057 -1.744233
C 4.225970 0.014883 1.069804
C -2.540939 -1.892173 0.152977
C -2.827306 -2.777532 1.315239
H -1.829728 1.745365 1.252597
H -2.076798 0.052863 -1.350999
H -4.082644 0.733372 0.769598
H -4.138116 2.497484 0.654224
H -4.127804 1.518544 -0.814704
H -1.965341 2.749271 -1.680178
H -2.070311 3.768925 -0.245054
H -0.576761 2.894355 -0.593407
H 0.085712 0.033768 1.752288
H -0.035687 0.465217 -2.562191
H 2.456234 0.431827 -2.703821
H 4.709276 -0.956376 1.238165
H 4.758171 0.904115 1.431848
H -2.677685 -2.268009 2.280376
H -2.167190 -3.659958 1.299910
H -3.863834 -3.147086 1.279909


%chk=000221920-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221920

0 1
O -2.186995 -0.694663 0.603049
O 3.020664 0.556336 1.663185
O 4.040862 -0.014199 -0.432241
O -2.334822 -2.107075 -1.253739
C -2.200304 1.735311 0.327460
C -1.663193 0.419434 -0.282696
C -0.150006 0.296025 -0.360673
C -3.743590 1.719372 0.408118
C -1.703637 2.943677 -0.503160
C 0.648707 0.511557 0.803908
C 0.461531 -0.050531 -1.589930
C 2.027329 0.368128 0.665795
C 2.630046 0.032384 -0.567123
C 1.871658 -0.182565 -1.718893
C 4.294741 0.131659 1.026460
C -2.445223 -1.920524 -0.020114
C -2.848508 -2.959278 1.005103
H -1.798350 1.827525 1.357034
H -2.098842 0.265555 -1.288431
H -4.103295 0.877875 1.023827
H -4.115794 2.660187 0.853222
H -4.189294 1.624720 -0.601102
H -2.074248 2.884045 -1.544875
H -2.080977 3.886068 -0.066676
H -0.601445 2.996271 -0.535874
H 0.198903 0.762467 1.767991
H -0.172416 -0.243692 -2.461180
H 2.340125 -0.448255 -2.669514
H 4.595211 -0.850136 1.438610
H 5.052492 0.915085 1.181606
H -3.499971 -2.518486 1.776700
H -1.943600 -3.343066 1.510702
H -3.355959 -3.797212 0.504752


