%chk=000253634.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253634

0 1
O -6.013156 0.756682 0.869374
O 4.908263 0.529004 -0.078797
O -0.379864 1.170885 -2.219176
O 5.673899 -1.421790 0.765533
C -1.504739 -0.783914 -0.196051
C -2.930130 -0.873134 0.356458
C -0.772655 0.383344 0.527631
C -3.701355 0.452217 0.076311
C 0.648635 0.576181 -0.089775
C -1.576271 1.704315 0.517943
C -3.051315 1.548626 0.926751
C -3.874450 -1.977944 -0.157560
C -0.736000 -2.097163 0.033281
C 1.371986 -0.758842 -0.214066
C -5.139667 0.042033 0.450455
C 1.443193 1.555003 0.812133
C -5.283456 -1.456393 0.192538
C -3.756334 0.855904 -1.402636
C 0.737345 -1.938502 -0.159637
C 2.854291 -0.707748 -0.467852
C 2.927113 1.663420 0.459857
C 3.563378 0.274133 0.466427
C 0.608647 1.143090 -1.522095
C 5.894101 -0.405845 0.149928
C 7.164299 0.063535 -0.467638
H -1.533932 -0.566039 -1.293828
H -2.854136 -1.000665 1.468517
H -0.632380 0.078531 1.595077
H -1.544645 2.149670 -0.499660
H -1.093424 2.436139 1.191594
H -3.137630 1.308286 2.002474
H -3.585466 2.509381 0.793976
H -3.668106 -2.948944 0.317512
H -3.762979 -2.129596 -1.244619
H -1.125320 -2.876630 -0.653646
H -0.922943 -2.484704 1.057999
H 1.342307 1.223074 1.866852
H 0.979907 2.560749 0.771176
H -5.700240 -1.956774 1.084341
H -6.011012 -1.638851 -0.616816
H -2.743830 1.047029 -1.799760
H -4.199210 0.078278 -2.032627
H -4.337311 1.774876 -1.539986
H 1.284488 -2.879036 -0.248334
H 3.317885 -1.712830 -0.349789
H 3.045376 -0.428025 -1.525667
H 3.077233 2.141920 -0.528813
H 3.448375 2.324534 1.180226
H 3.682402 -0.142959 1.489569
H 1.576249 1.523501 -1.891575
H 7.471753 1.042541 -0.066989
H 7.061680 0.190143 -1.556962
H 7.979953 -0.652899 -0.282480


%chk=000253634-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000253634

0 1
O -6.004996 0.651098 1.251430
O 5.045693 0.511224 -0.013551
O -0.472293 1.337632 -2.437226
O 5.552626 -1.465862 1.122534
C -1.525121 -0.762716 -0.333094
C -2.921437 -0.897165 0.296303
C -0.770861 0.425496 0.353110
C -3.756470 0.412447 0.190369
C 0.635023 0.664363 -0.297372
C -1.612412 1.735720 0.462752
C -3.052178 1.516921 1.002364
C -3.891206 -2.009282 -0.188506
C -0.708349 -2.064964 -0.165179
C 1.413017 -0.670053 -0.434303
C -5.126260 -0.061025 0.708624
C 1.463256 1.675050 0.582654
C -5.247735 -1.581517 0.443539
C -4.013359 0.872893 -1.281935
C 0.777559 -1.872338 -0.356269
C 2.918369 -0.598126 -0.667366
C 2.978720 1.744991 0.280708
C 3.598629 0.348520 0.340131
C 0.559933 1.219467 -1.733308
C 5.924044 -0.479606 0.446389
C 7.339674 -0.169722 0.011031
H -1.626428 -0.543370 -1.411509
H -2.762726 -1.072171 1.388235
H -0.563440 0.086663 1.394953
H -1.668449 2.223310 -0.525774
H -1.095203 2.443846 1.138174
H -3.016273 1.215059 2.068988
H -3.620393 2.464718 0.956878
H -3.580049 -3.017761 0.135304
H -3.953820 -2.021744 -1.292848
H -1.072876 -2.836002 -0.873679
H -0.884290 -2.489753 0.849006
H 1.323924 1.366610 1.638457
H 1.030041 2.687765 0.489096
H -5.422193 -2.080788 1.416590
H -6.133963 -1.794575 -0.180961
H -3.070630 1.103910 -1.805957
H -4.545475 0.105300 -1.872965
H -4.641028 1.782286 -1.273349
H 1.388813 -2.785362 -0.416212
H 3.354138 -1.608973 -0.587211
H 3.146866 -0.218599 -1.685051
H 3.171876 2.179189 -0.718794
H 3.469226 2.408716 1.016196
H 3.542464 -0.081422 1.358673
H 1.549700 1.521668 -2.161834
H 7.639760 0.829093 0.371946
H 7.401900 -0.151519 -1.091084
H 8.025464 -0.931743 0.408004


