%chk=000183549.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183549

0 1
O 4.673487 -0.866037 0.997412
O 3.702802 1.739144 -2.359191
O -5.353184 1.411266 -0.918122
O -6.596916 0.652161 0.794760
C 0.967944 0.045409 0.447888
C 0.151011 -1.284813 0.476990
C 2.491607 -0.088553 0.131802
C 0.417987 -2.053281 -0.857679
C 2.690466 -0.945883 -1.137723
C 1.923756 -2.267415 -1.087686
C 0.782997 0.894110 1.719960
C -1.367953 -0.943460 0.585542
C 3.033472 1.326585 -0.061007
C 0.493228 -2.154804 1.697063
C 3.279289 -0.732233 1.305583
C 1.341742 2.310830 1.519641
C -0.313148 -3.398290 -0.932272
C 2.515838 2.376880 0.592639
C -1.914722 -0.095363 -0.569682
C 4.180652 1.532243 -1.018975
C -3.331308 0.302720 -0.393824
C -3.982733 1.247385 -1.392143
C -4.235614 -0.032612 0.543570
C -5.526373 0.639693 0.259713
H 0.542415 0.640857 -0.408287
H 0.035527 -1.413779 -1.694295
H 3.774949 -1.168062 -1.254263
H 2.392512 -0.362850 -2.034978
H 2.082053 -2.820253 -2.034279
H 2.344072 -2.919450 -0.296452
H 1.280659 0.409993 2.582100
H -0.289571 0.951992 1.991338
H -1.548075 -0.416180 1.545189
H -1.944184 -1.888277 0.650623
H 0.367834 -1.611550 2.638572
H -0.142135 -3.045930 1.750423
H 1.534494 -2.510192 1.656158
H 2.966185 -1.785703 1.472202
H 3.163936 -0.158019 2.240344
H 1.619036 2.745485 2.502827
H 0.544024 2.974618 1.120014
H 0.077551 -4.119097 -0.205055
H -1.386504 -3.289206 -0.740617
H -0.204130 -3.851646 -1.924186
H 2.921044 3.382539 0.456235
H -1.806093 -0.657323 -1.527671
H -1.278801 0.814411 -0.694563
H 4.883989 0.675428 -1.023306
H 4.747788 2.463590 -0.823530
H 5.112052 0.007739 1.021337
H 3.084316 1.010467 -2.609767
H -3.542250 2.258183 -1.408456
H -4.059173 0.839106 -2.413657
H -4.133847 -0.678672 1.398838


%chk=000183549-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000183549

0 1
O 4.770427 -0.517711 1.320329
O 4.068061 1.613107 -2.404680
O -5.602002 1.229150 -0.841740
O -6.778383 0.175711 0.895465
C 1.009463 0.057967 0.426593
C 0.133836 -1.258970 0.470254
C 2.548733 -0.124783 0.110740
C 0.376342 -2.053889 -0.872156
C 2.674794 -0.959772 -1.200949
C 1.883988 -2.280991 -1.146367
C 0.817843 0.998104 1.646207
C -1.387960 -0.881430 0.592558
C 3.170421 1.281616 -0.078468
C 0.436029 -2.148661 1.709200
C 3.337170 -0.852119 1.266107
C 1.376498 2.410584 1.352550
C -0.379295 -3.400432 -0.974854
C 2.637677 2.386275 0.518688
C -1.958755 0.112761 -0.442354
C 4.402320 1.459122 -0.964545
C -3.441523 0.343881 -0.315074
C -4.192667 1.245206 -1.283186
C -4.334195 -0.144738 0.593198
C -5.698163 0.372518 0.315816
H 0.640552 0.618879 -0.461625
H 0.011163 -1.402428 -1.697849
H 3.743553 -1.171474 -1.405949
H 2.276330 -0.356530 -2.043406
H 1.993544 -2.808411 -2.114569
H 2.307881 -2.965190 -0.384518
H 1.324315 0.583516 2.537855
H -0.249982 1.084301 1.916558
H -1.575857 -0.481358 1.607816
H -1.972095 -1.819609 0.533387
H 0.416721 -1.552706 2.639665
H -0.330407 -2.938225 1.814899
H 1.414669 -2.651089 1.650582
H 3.340304 -1.942577 1.115653
H 2.873277 -0.636761 2.247854
H 1.555428 2.960213 2.298821
H 0.618615 3.012097 0.804582
H -0.029191 -4.121152 -0.213175
H -1.472558 -3.291824 -0.862022
H -0.198108 -3.857831 -1.965577
H 3.120043 3.359580 0.340579
H -1.746443 -0.236590 -1.474331
H -1.447730 1.094877 -0.359898
H 5.123629 0.632165 -0.824198
H 4.899028 2.412817 -0.715046
H 4.852489 0.442833 1.554750
H 3.928717 0.716212 -2.798557
H -3.832308 2.290963 -1.258992
H -4.150406 0.875939 -2.325348
H -4.141833 -0.819246 1.425822


