%chk=000182956.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182956

0 1
O 0.924725 1.886440 -0.733516
O 3.869836 1.673825 -1.065429
O -0.483849 -2.833400 -1.637293
O 5.104684 -0.481336 0.045643
O -4.686471 0.965135 1.606043
O -4.253029 0.361032 -1.260418
C 1.670029 -1.283088 0.942348
C 0.885738 -2.362934 1.640806
C 0.965430 -0.192644 0.388258
C 0.116966 -3.219627 0.630990
C -0.508427 -0.116749 0.533974
C -1.270600 -1.160272 -0.139614
C -0.521872 -2.434530 -0.497640
C 1.674175 0.822050 -0.293361
C 3.058169 -1.382729 0.823598
C 3.075206 0.746304 -0.395049
C 3.751099 -0.367634 0.152482
C -1.028555 0.872187 1.304990
C -2.556832 -1.101606 -0.531573
C -2.404298 1.100604 1.655403
C -3.490804 0.025747 -0.377039
C -3.498818 0.696676 0.967313
C 1.197212 2.355305 -2.085576
C 4.106154 2.880168 -0.280401
C -5.916824 0.873546 0.838359
H 1.549879 -3.014069 2.246023
H 0.183117 -1.902344 2.370387
H -0.671176 -3.806009 1.148408
H 0.800700 -3.976115 0.182107
H 3.610073 -2.227336 1.229789
H -0.328528 1.589026 1.762557
H -2.999052 -1.935070 -1.099177
H -2.568004 1.678756 2.575873
H 5.473484 0.276005 -0.509819
H 2.266535 2.530614 -2.244950
H 0.617842 3.284575 -2.121416
H 0.807108 1.614147 -2.790795
H 4.715219 3.483700 -0.961423
H 3.154701 3.370816 -0.051801
H 4.649401 2.631776 0.634291
H -6.649909 1.264795 1.553731
H -5.858868 1.496252 -0.062869
H -6.120365 -0.169387 0.582786


%chk=000182956-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000182956

0 1
O 1.333890 2.011367 -0.704259
O 4.217276 1.759384 -0.519433
O -0.715198 -2.718582 -2.019835
O 5.322673 -0.432740 0.600152
O -4.584331 1.627191 1.235308
O -4.801140 -0.341021 -0.834495
C 1.737336 -1.372329 0.903704
C 0.883275 -2.543044 1.355346
C 1.092942 -0.219362 0.358400
C 0.278560 -3.264872 0.126780
C -0.402839 -0.095562 0.352152
C -1.213040 -1.126763 -0.261575
C -0.526162 -2.372876 -0.822494
C 1.907693 0.849766 -0.125265
C 3.144962 -1.442497 0.979068
C 3.315168 0.787945 -0.024455
C 3.932817 -0.368428 0.525098
C -0.933650 1.064889 0.946380
C -2.591068 -1.127107 -0.497207
C -2.274353 1.475094 1.162946
C -3.676864 -0.187025 -0.222627
C -3.495454 0.923325 0.749936
C 0.887130 1.818518 -2.104847
C 4.036072 3.147567 -0.024742
C -5.958835 1.065673 1.248411
H 1.486175 -3.264132 1.934442
H 0.068345 -2.195245 2.018565
H -0.414349 -4.066214 0.461261
H 1.065417 -3.758525 -0.472171
H 3.642452 -2.321781 1.398576
H -0.186976 1.752683 1.358975
H -2.963091 -1.971145 -1.095359
H -2.397772 2.380957 1.771029
H 5.681140 0.399313 0.182279
H 1.750937 1.570636 -2.748964
H 0.444368 2.778769 -2.409096
H 0.128557 1.016937 -2.167303
H 4.815695 3.737299 -0.529985
H 3.031264 3.512231 -0.289906
H 4.179588 3.182618 1.071907
H -6.542426 1.826822 1.787684
H -6.321848 0.904723 0.224221
H -5.973134 0.108144 1.798397


