%chk=000186998.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186998

0 1
O -4.148941 1.981513 0.014055
O -4.270924 -0.242886 1.240831
O -3.686615 -2.750883 -0.424911
C -3.426100 0.935529 -0.624756
C -1.935377 1.058524 -0.384871
C -1.115461 -0.047869 -0.339442
C -4.021452 -0.426279 -0.161945
C 0.321007 0.119600 -0.177139
C 0.847534 1.448323 -0.056541
C -1.694074 -1.388286 -0.444462
C -3.027416 -1.550156 -0.360206
C -1.395481 2.382925 -0.257269
C 1.206417 -0.967125 -0.131471
C -0.057675 2.573044 -0.097569
C 2.587338 -0.778736 0.025657
C 2.228402 1.639738 0.100538
C 3.108885 0.549775 0.143519
C 3.506129 -1.893287 0.072796
C 4.534412 0.726225 0.304515
C 4.844070 -1.685636 0.225971
C 5.367816 -0.350920 0.343897
H -3.647000 1.102880 -1.709632
H -4.988857 -0.641685 -0.671252
H -1.010842 -2.224276 -0.577694
H -2.098092 3.220404 -0.287065
H 0.816137 -1.982553 -0.218701
H 0.361778 3.572956 0.003198
H 2.621860 2.651933 0.191111
H -4.144369 1.845860 0.998933
H -4.701293 -1.042826 1.614562
H 3.097015 -2.898200 -0.017080
H 4.917058 1.741989 0.392893
H -3.066124 -3.518512 -0.516879
H 5.545573 -2.517415 0.263006
H 6.443262 -0.230288 0.464905


%chk=000186998-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000186998

0 1
O -4.248308 2.037724 -0.154530
O -4.284171 -0.195226 1.311749
O -3.759488 -2.786610 -0.390562
C -3.441668 0.924443 -0.653397
C -1.948380 1.081536 -0.352470
C -1.115362 -0.053702 -0.332314
C -4.033136 -0.405639 -0.140711
C 0.323458 0.110646 -0.169350
C 0.862430 1.463006 -0.023343
C -1.728772 -1.385930 -0.452600
C -3.082655 -1.552789 -0.367761
C -1.405875 2.395470 -0.199933
C 1.233565 -0.975936 -0.142136
C -0.038120 2.584584 -0.035266
C 2.630517 -0.790497 0.011264
C 2.258702 1.649029 0.131870
C 3.161619 0.560366 0.151304
C 3.550127 -1.900280 0.034496
C 4.583816 0.737045 0.306899
C 4.917582 -1.692887 0.186552
C 5.440784 -0.358655 0.324223
H -3.572276 0.944792 -1.753899
H -4.995562 -0.604148 -0.650827
H -1.084648 -2.265413 -0.570682
H -2.102076 3.239627 -0.213455
H 0.869348 -2.004743 -0.236269
H 0.374478 3.592940 0.085494
H 2.646551 2.669980 0.240127
H -4.436245 1.827761 0.801048
H -4.791416 -0.966998 1.665568
H 3.152195 -2.917070 -0.070320
H 4.979674 1.754382 0.411976
H -3.125159 -3.544761 -0.456600
H 5.606777 -2.544385 0.202562
H 6.520297 -0.214261 0.442796


