%chk=000225753.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225753

0 1
O -3.432633 -0.048944 -1.992582
O 0.433694 -2.547194 0.402470
O -5.353894 -0.023077 0.821990
O 5.630532 -0.002935 -1.867784
C -1.204586 1.114220 -0.257260
C 0.143342 1.035895 0.471517
C -2.082089 -0.134919 0.074874
C 0.903640 -0.219002 -0.038278
C 2.273680 -0.400769 0.691883
C -3.441516 0.273847 -0.592962
C 3.121561 0.910342 0.599037
C -2.137258 2.305072 0.022120
C 0.994928 2.290644 0.226210
C -1.391323 -1.362472 -0.522912
C -3.542176 1.803435 -0.376662
C 2.328167 2.176085 0.967191
C 0.029502 -1.475187 0.009048
C 3.031626 -1.578888 0.007014
C -2.305250 -0.345857 1.576553
C 3.787038 1.051545 -0.778568
C 2.054912 -0.734928 2.176889
C 4.521952 -1.332054 -0.215847
C -4.666395 -0.502824 -0.049516
C 4.746291 -0.087746 -1.045628
C -4.915026 -1.842734 -0.656489
H -0.992540 1.111165 -1.357275
H -0.031053 0.932145 1.571724
H 1.135685 -0.053873 -1.124547
H 3.945547 0.819712 1.355997
H -1.845970 3.199080 -0.550975
H -2.110492 2.596928 1.086560
H 0.451107 3.191233 0.570128
H 1.169096 2.439775 -0.855926
H -1.390427 -1.318440 -1.631079
H -1.948439 -2.292770 -0.287484
H -4.285192 2.030024 0.415565
H -3.917650 2.301372 -1.285537
H 2.944988 3.074128 0.768126
H 2.146173 2.181631 2.060953
H 2.565687 -1.822100 -0.968426
H 2.888236 -2.504595 0.604101
H -2.837174 -1.282300 1.783557
H -1.357151 -0.393914 2.127255
H -2.897717 0.463531 2.024024
H 4.325702 2.017081 -0.861704
H 3.028855 1.081774 -1.586389
H 1.469520 -1.659335 2.291110
H 3.005112 -0.897746 2.696050
H 1.520187 0.060526 2.704233
H 4.989278 -2.208022 -0.712187
H 5.058731 -1.229829 0.749362
H -2.895685 0.599707 -2.493035
H -4.853828 -1.796361 -1.759159
H -4.164760 -2.578519 -0.335104
H -5.905046 -2.235361 -0.384727


%chk=000225753-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225753

0 1
O -3.277476 0.051326 -2.077895
O 0.370910 -2.565763 0.802877
O -5.385446 -0.269981 0.765402
O 5.676624 -0.096013 -2.003985
C -1.246793 1.103362 -0.134215
C 0.131400 1.060036 0.554189
C -2.131196 -0.150063 0.164710
C 0.893997 -0.243738 0.119104
C 2.325281 -0.397836 0.749111
C -3.454920 0.260945 -0.620357
C 3.155596 0.922898 0.502972
C -2.192769 2.298447 0.144813
C 0.990327 2.296514 0.203071
C -1.405864 -1.407905 -0.370795
C -3.609010 1.775768 -0.275052
C 2.379214 2.213355 0.866746
C -0.003634 -1.500037 0.242590
C 3.058898 -1.606007 0.048794
C -2.425224 -0.326964 1.677537
C 3.749251 0.969019 -0.928289
C 2.257791 -0.653673 2.280624
C 4.563412 -1.363449 -0.220404
C -4.686620 -0.588304 -0.234214
C 4.763052 -0.160333 -1.139843
C -4.998921 -1.806413 -1.080188
H -1.036693 1.088532 -1.231210
H -0.012210 1.044335 1.654054
H 1.033960 -0.130158 -0.984237
H 4.021338 0.876692 1.197346
H -1.898906 3.202693 -0.415919
H -2.173890 2.562190 1.218621
H 0.473302 3.217128 0.535303
H 1.090827 2.369678 -0.900740
H -1.334094 -1.336004 -1.474934
H -1.939142 -2.341791 -0.119650
H -4.341216 1.883468 0.542671
H -4.020313 2.314834 -1.148398
H 2.989032 3.094881 0.587310
H 2.247450 2.263091 1.965902
H 2.571763 -1.825475 -0.922260
H 2.923727 -2.513758 0.659147
H -3.037222 -1.228685 1.853052
H -1.489953 -0.455886 2.250682
H -2.977879 0.526331 2.103949
H 4.250641 1.932655 -1.135484
H 2.957589 0.863504 -1.699345
H 1.659384 -1.551586 2.501525
H 3.277704 -0.817150 2.678575
H 1.824887 0.201515 2.831680
H 5.045354 -2.246559 -0.675643
H 5.099556 -1.165857 0.731742
H -2.758305 0.808198 -2.447483
H -5.293234 -1.483262 -2.095064
H -4.100721 -2.434944 -1.216236
H -5.811117 -2.385600 -0.614758


