%chk=000187314.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187314

0 1
O -2.989258 -0.813815 1.099846
O -4.640161 0.522171 -0.430615
C -0.964493 -0.225682 -0.114976
C -2.448601 -0.503006 -0.197326
C -0.510522 1.065864 0.000491
C -0.042324 -1.344500 -0.124675
C -3.264216 0.694896 -0.759710
C 0.916945 1.345318 0.048939
C 1.350539 -1.097356 -0.081870
C 1.838355 0.273232 -0.003776
C -1.472761 2.177355 0.081990
C -2.761564 2.015163 -0.240685
C -0.503359 -2.689936 -0.166242
C 1.410996 2.676126 0.133509
C 2.246955 -2.200461 -0.107489
C 3.230926 0.560633 0.026545
C 0.386218 -3.744466 -0.185009
C 1.778200 -3.497367 -0.160698
C 2.766755 2.931487 0.162795
C 3.687828 1.860194 0.107871
H -2.685078 -1.426915 -0.779673
H -3.261319 0.697486 -1.878149
H -1.085566 3.138926 0.426876
H -3.508951 2.803973 -0.172794
H -1.578427 -2.884523 -0.168731
H 0.700096 3.504153 0.173152
H 3.321653 -2.009456 -0.082088
H 3.942374 -0.266583 -0.016221
H -2.581620 -0.242471 1.788930
H 0.026276 -4.772144 -0.215524
H 2.470594 -4.337484 -0.180561
H 3.138080 3.953115 0.226621
H 4.755999 2.072300 0.130079
H -4.723668 0.135873 0.483670


%chk=000187314-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000187314

0 1
O -3.008182 -0.860767 1.133159
O -4.719396 0.478403 -0.486147
C -0.971867 -0.221597 -0.153169
C -2.470371 -0.480753 -0.215452
C -0.508433 1.097094 -0.014507
C -0.048405 -1.343928 -0.146786
C -3.297301 0.713636 -0.754477
C 0.926669 1.367266 0.039474
C 1.373947 -1.104166 -0.084633
C 1.866710 0.273321 -0.008022
C -1.490580 2.197542 0.112218
C -2.808229 2.029265 -0.190671
C -0.521595 -2.696599 -0.175979
C 1.432304 2.704888 0.110140
C 2.254365 -2.229269 -0.091976
C 3.263639 0.573478 0.026484
C 0.365485 -3.777680 -0.174692
C 1.768191 -3.541479 -0.141824
C 2.806151 2.968697 0.143292
C 3.731733 1.890399 0.104029
H -2.712406 -1.356968 -0.835449
H -3.206204 0.736101 -1.859322
H -1.148019 3.168434 0.481455
H -3.543675 2.834117 -0.084679
H -1.596801 -2.892159 -0.168339
H 0.738912 3.549572 0.117326
H 3.336171 -2.076725 -0.050995
H 3.996160 -0.237193 -0.011559
H -2.538191 -0.318946 1.818847
H -0.018379 -4.803253 -0.191665
H 2.467182 -4.384775 -0.145209
H 3.166317 4.001788 0.192557
H 4.808594 2.088974 0.127705
H -4.747593 0.025383 0.403368


