%chk=000183236.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183236

0 1
O -3.335787 -1.403284 -0.845782
O -3.711783 1.640772 0.736989
O -3.771886 -2.870575 0.819797
O -5.287624 2.780891 -0.417321
C 2.866326 -1.259634 0.319064
C 3.744713 -0.209611 -0.002219
C 1.493113 -1.027624 0.274464
C 3.675672 -2.482931 0.674281
C 1.013756 0.265166 -0.167482
C 5.169910 -2.058794 0.490662
C 5.131645 -0.606014 0.088865
C 3.322961 1.093854 -0.319009
C 1.922917 1.335225 -0.350088
C -0.430530 0.375955 -0.374334
C -1.284053 -0.580573 0.130896
C -2.781615 -0.421411 0.098050
C 0.558014 -2.033191 0.722700
C -3.318676 0.905934 -0.473557
C -0.777912 -1.794860 0.714762
C 6.103279 0.312707 -0.161495
C -1.005083 1.449826 -1.195627
C 4.387333 2.038436 -0.571449
C -2.317485 1.716613 -1.231557
C 1.471734 2.753015 -0.501764
C 5.699655 1.655457 -0.501040
C -3.814334 -2.600299 -0.357429
C -4.723926 2.573176 0.630215
C -4.341623 -3.400866 -1.494564
C -4.943180 3.191613 1.965229
H 3.421616 -3.334658 0.019552
H 3.481472 -2.804920 1.712465
H 5.740927 -2.201676 1.424423
H 5.663875 -2.673886 -0.281849
H -3.214687 -0.608417 1.116608
H 0.962407 -2.974552 1.093160
H -4.236638 0.723348 -1.090088
H -1.493562 -2.518018 1.115859
H 7.161444 0.078879 -0.112036
H -0.311861 2.002943 -1.838809
H 4.117776 3.062096 -0.825743
H -2.737972 2.520469 -1.836252
H 0.633768 2.983550 0.174640
H 1.147477 2.970303 -1.531573
H 2.266904 3.472603 -0.258256
H 6.492836 2.375852 -0.701764
H -4.216214 -2.889738 -2.463785
H -5.415103 -3.609951 -1.360891
H -3.826226 -4.372587 -1.559568
H -4.242258 2.810506 2.726460
H -5.966403 2.994613 2.323316
H -4.821708 4.285267 1.913375


%chk=000183236-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000183236

0 1
O -3.314251 -1.436068 -1.106606
O -3.585148 1.576800 0.976548
O -3.880053 -3.110825 0.424706
O -5.070959 3.030347 -0.080627
C 2.830473 -1.209036 0.477711
C 3.701084 -0.201534 0.032206
C 1.434092 -0.998217 0.403908
C 3.641089 -2.392591 0.998767
C 0.925070 0.265045 -0.166605
C 5.141385 -2.002174 0.708552
C 5.077853 -0.576451 0.163191
C 3.253523 1.084544 -0.420055
C 1.841641 1.334968 -0.477900
C -0.525711 0.349485 -0.365624
C -1.377136 -0.624566 0.200484
C -2.880854 -0.531534 0.034224
C 0.518271 -1.977385 0.921669
C -3.419682 0.850783 -0.349772
C -0.852575 -1.772048 0.875982
C 6.062254 0.341508 -0.183814
C -1.153597 1.355977 -1.245591
C 4.305165 2.013238 -0.765435
C -2.496341 1.602022 -1.266477
C 1.404562 2.769976 -0.749543
C 5.649568 1.641742 -0.656227
C -3.801386 -2.701561 -0.757177
C -4.458148 2.669652 0.950793
C -4.207359 -3.477934 -1.991119
C -4.551927 3.320631 2.314485
H 3.362924 -3.339073 0.497975
H 3.474737 -2.548496 2.082550
H 5.763014 -2.064823 1.620415
H 5.591798 -2.690582 -0.031393
H -3.387715 -0.894182 0.947345
H 0.926486 -2.887725 1.373637
H -4.425818 0.757219 -0.794960
H -1.550436 -2.501668 1.299865
H 7.129323 0.106285 -0.103211
H -0.514952 1.881876 -1.958422
H 4.059595 3.013243 -1.136275
H -2.937133 2.333707 -1.948946
H 0.412825 2.988604 -0.325975
H 1.377275 3.020459 -1.828869
H 2.118386 3.468861 -0.279027
H 6.424410 2.365018 -0.936994
H -4.017692 -2.901018 -2.907117
H -5.279409 -3.733159 -1.925412
H -3.645864 -4.427543 -2.024136
H -3.894962 2.823856 3.042369
H -5.597094 3.279186 2.667565
H -4.277202 4.386160 2.228868


