%chk=000229896.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229896

0 1
O 2.351180 1.080316 1.108990
O -1.127127 0.214465 -1.312758
O -0.425180 2.680906 0.455759
O -3.313917 -0.025276 -0.797360
C -0.651673 -1.975823 1.459922
C -0.519369 -2.187301 -0.052334
C 0.725624 -1.850568 2.127021
C -1.843714 -1.978766 -0.794174
C 3.145324 0.208314 -0.935300
C 2.650824 1.485131 -0.257125
C 2.100207 -0.400017 -1.876788
C 0.603937 -1.658794 3.636580
C -2.225336 -0.531644 -0.939977
C 1.379004 1.904513 1.772185
C -0.028512 1.556729 1.288132
C -1.300187 1.636633 -1.578336
C -1.612436 2.437479 -0.314044
C 2.595892 -1.696753 -2.510697
H -1.253471 -1.071192 1.671945
H -1.214989 -2.815069 1.911688
H -0.140867 -3.207562 -0.256752
H 0.254112 -1.492459 -0.475286
H 1.290483 -0.997118 1.686429
H 1.333537 -2.750277 1.911694
H -2.672154 -2.513302 -0.278450
H -1.781344 -2.427816 -1.810109
H 3.415148 -0.526149 -0.143991
H 4.083588 0.409952 -1.485171
H 3.436041 2.257312 -0.189057
H 1.751800 1.915733 -0.731090
H 1.152825 -0.593525 -1.310942
H 1.830703 0.325715 -2.667588
H 1.592870 -1.557058 4.099153
H 0.103851 -2.508287 4.114944
H 0.032904 -0.757848 3.885798
H 1.532240 1.630361 2.832845
H 1.602822 2.976737 1.623652
H -0.753593 1.471262 2.113500
H -0.025243 0.628758 0.681353
H -2.089999 1.752282 -2.340891
H -0.304462 1.889039 -1.992617
H -2.392398 1.950228 0.300033
H -1.937489 3.466326 -0.568325
H 2.830095 -2.453133 -1.752853
H 1.841401 -2.123460 -3.180734
H 3.504949 -1.535989 -3.101675


%chk=000229896-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000229896

0 1
O 2.913074 0.742859 0.126082
O -1.927686 -0.224305 -0.929774
O 0.067520 2.078571 0.033790
O -4.097655 0.160736 -0.167027
C -1.798549 -1.940279 2.198353
C -1.880133 -2.570004 0.789714
C -0.521376 -2.350831 2.965650
C -3.121484 -2.111890 -0.017544
C 4.162018 1.323880 -1.869787
C 3.054882 1.782115 -0.915060
C 3.811541 0.027945 -2.635951
C -0.425866 -1.702815 4.363852
C -3.139988 -0.627032 -0.344435
C 1.974435 1.082801 1.193144
C 0.499853 0.907579 0.819348
C -1.841995 1.202722 -1.358070
C -1.371039 2.131663 -0.230868
C 4.940849 -0.423329 -3.586425
H -1.829505 -0.834286 2.113369
H -2.693148 -2.229082 2.787922
H -1.913285 -3.673598 0.883209
H -0.966752 -2.323908 0.216135
H 0.368559 -2.072029 2.364199
H -0.492741 -3.455074 3.064631
H -4.053357 -2.333115 0.531053
H -3.156877 -2.663082 -0.977910
H 5.093533 1.172762 -1.289197
H 4.359759 2.142666 -2.592593
H 3.319720 2.747922 -0.430027
H 2.091047 1.918704 -1.445385
H 3.591746 -0.767620 -1.900081
H 2.878495 0.189836 -3.214656
H 0.496042 -2.009633 4.890820
H -1.287814 -1.990170 4.994942
H -0.421427 -0.598290 4.289712
H 2.216387 0.379358 2.011402
H 2.137830 2.122678 1.552248
H -0.113823 0.843291 1.747485
H 0.361799 -0.026267 0.239236
H -2.837820 1.523745 -1.715466
H -1.112612 1.194233 -2.183667
H -1.955603 1.934094 0.692668
H -1.557931 3.174665 -0.545397
H 5.874623 -0.617408 -3.025279
H 4.671626 -1.351557 -4.123626
H 5.161030 0.353784 -4.343541


