%chk=000189826.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189826

0 1
O 6.713084 -0.670863 0.638388
O -5.375287 2.053584 -0.519513
O -5.425212 1.477531 1.640319
C -3.776103 -0.849078 0.506238
C -3.515758 -2.251960 -0.058240
C 5.516948 -0.301923 -0.088407
C 5.123121 1.138745 0.301101
C -5.052386 -0.239411 -0.086407
C -2.163804 -2.746848 0.365342
C 4.026983 1.661833 -0.575320
C 0.129326 -3.631785 -0.087897
C 4.504490 -1.322534 0.350613
C -1.232729 -3.153441 -0.501808
C 1.686215 2.436366 -0.988925
C 2.789102 1.893753 -0.127211
C 3.340852 -1.505800 -0.285062
C 1.186991 -2.657511 -0.516445
C -5.296798 1.120521 0.493430
C 2.335355 -2.475859 0.150918
C 0.341723 1.942141 -0.536035
C -0.675872 2.755787 -0.241654
C -2.023888 2.274445 0.207704
C -2.361639 2.810569 1.597989
H -2.903702 -0.182949 0.288961
H -3.853050 -0.888481 1.612499
H -4.293940 -2.959481 0.298420
H -3.609359 -2.241617 -1.163474
H 5.744838 -0.379753 -1.175795
H 4.836336 1.157149 1.373759
H 6.009132 1.801124 0.230122
H -4.981704 -0.181557 -1.195770
H -5.931343 -0.885803 0.129959
H -1.991290 -2.747123 1.442097
H 4.312029 1.839227 -1.611265
H 4.807398 -1.896330 1.229549
H 0.334627 -4.623039 -0.553374
H 0.177391 -3.813400 1.006945
H -1.403768 -3.148296 -1.578792
H 1.735159 3.548161 -0.970804
H 1.833024 2.157310 -2.055131
H 2.509863 1.708685 0.912223
H 3.080220 -0.909000 -1.164511
H 0.958126 -2.095794 -1.423763
H 2.568409 -3.038733 1.056692
H 0.258888 0.857190 -0.463536
H 7.453635 -0.083169 0.407457
H -0.582279 3.840572 -0.302771
H -2.077618 1.158530 0.214132
H -2.794627 2.599467 -0.524344
H -1.611457 2.502492 2.336371
H -3.334942 2.441038 1.949228
H -2.400417 3.905132 1.613853
H -5.537292 2.975585 -0.184653


%chk=000189826-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000189826

0 1
O 6.665235 -0.995868 0.542164
O -7.072349 1.204142 -0.206592
O -5.193654 1.530324 1.114078
C -4.030217 -1.001703 0.259019
C -3.669052 -2.410618 -0.279145
C 5.466378 -0.423036 -0.118059
C 5.387915 1.109698 0.172498
C -5.416033 -0.543101 -0.232361
C -2.341257 -2.915762 0.246908
C 4.294445 1.805892 -0.606875
C 0.020894 -3.859925 0.012304
C 4.287550 -1.178803 0.433670
C -1.301342 -3.328584 -0.522237
C 2.138683 3.154288 -0.837182
C 3.255980 2.484694 -0.054515
C 3.333937 -1.791905 -0.325376
C 1.221445 -3.114173 -0.538719
C -5.826718 0.810928 0.310769
C 2.172574 -2.493392 0.220538
C 0.776663 2.559469 -0.506994
C -0.276911 3.258663 -0.008656
C -1.631915 2.676107 0.335621
C -2.024167 2.889916 1.820702
H -3.259615 -0.273730 -0.055652
H -4.014691 -1.007086 1.365566
H -4.475757 -3.116015 0.017375
H -3.651320 -2.398902 -1.387183
H 5.533237 -0.573682 -1.218338
H 5.250154 1.259258 1.259749
H 6.374319 1.550331 -0.097778
H -5.453041 -0.491888 -1.338095
H -6.199808 -1.272058 0.056109
H -2.236637 -2.943582 1.343837
H 4.358362 1.736123 -1.705246
H 4.224214 -1.202027 1.531435
H 0.108563 -4.932636 -0.271804
H 0.023879 -3.822735 1.117861
H -1.399698 -3.291628 -1.619286
H 2.116939 4.240789 -0.615540
H 2.347440 3.048325 -1.921523
H 3.174810 2.544505 1.041922
H 3.427579 -1.768509 -1.422465
H 1.314783 -3.085429 -1.636366
H 2.078160 -2.515307 1.317043
H 0.673069 1.476964 -0.680106
H 7.446449 -0.421915 0.329492
H -0.155081 4.339199 0.178548
H -1.641851 1.593673 0.101090
H -2.411091 3.145830 -0.300599
H -1.306741 2.384255 2.492325
H -3.034700 2.487629 2.009710
H -2.025131 3.966286 2.077969
H -7.317877 2.092114 0.171791


