%chk=000271629.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271629

0 1
O -0.530483 -1.216334 -0.302725
O -3.159683 -4.190845 -1.246852
O 0.048960 -0.769401 2.153746
O -6.368050 -2.103250 1.529469
O 3.414625 2.320563 2.935168
O 0.831432 -3.071784 -3.663270
O -5.849591 0.216572 2.401266
O 4.960528 3.002126 1.034420
C -2.688828 -2.038004 -0.398236
C 1.477827 -0.188766 0.244880
C -1.388920 -2.043582 -1.059238
C 0.808249 -1.073716 -0.700504
C -4.307025 -0.909413 1.056440
C 3.228854 1.474187 0.664396
C -3.094923 -0.930790 0.355603
C 2.550465 0.596922 -0.191736
C -3.581407 -3.148944 -0.486105
C 1.078835 -0.076716 1.615496
C -0.960359 -2.662831 -2.168935
C 1.284608 -1.692904 -1.794054
C -5.176477 -2.040640 0.936303
C 2.815803 1.537781 2.034737
C -4.809450 -3.162828 0.167343
C 1.738112 0.769366 2.505084
C 0.427668 -2.534952 -2.653136
C -4.727239 0.223322 1.889307
C 4.349192 2.308372 0.220818
C -3.813183 1.379124 2.108251
C 4.745839 2.307369 -1.217810
C -2.522711 1.195441 2.625816
C 3.863777 2.792550 -2.193799
C -4.283781 2.670690 1.827813
C 6.021152 1.852183 -1.577340
C -1.698311 2.303119 2.838796
C 4.256518 2.805681 -3.534220
C -3.451878 3.773544 2.038056
C 6.404280 1.860551 -2.921937
C -2.159908 3.590158 2.541837
C 5.523506 2.335439 -3.898829
H -2.432113 -0.053209 0.393451
H 2.868404 0.523211 -1.240917
H -1.622090 -3.302243 -2.760681
H 2.327618 -1.622431 -2.101186
H -5.498203 -4.002017 0.102944
H 1.442130 0.822123 3.552982
H -2.157048 0.195984 2.872128
H 2.880745 3.167081 -1.908006
H -5.299007 2.810238 1.452482
H 6.712041 1.498192 -0.810915
H -3.812454 -4.947141 -1.263807
H -0.393817 -1.415609 1.512422
H -6.602216 -1.222487 2.079063
H 4.233064 2.858701 2.533827
H -0.692502 2.160771 3.237113
H 3.575595 3.183190 -4.296692
H -3.813907 4.776790 1.815545
H 7.392917 1.500998 -3.206539
H -1.512554 4.451588 2.708095
H 5.824873 2.342310 -4.946629


%chk=000271629-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000271629

0 1
O -0.511079 -1.290372 -0.194693
O -3.226681 -4.336255 -1.172249
O 0.089870 -0.544219 2.231343
O -6.675232 -1.980243 1.236603
O 3.899637 2.242159 2.836242
O 0.872530 -3.287745 -3.551531
O -6.236951 0.338194 2.023277
O 5.471160 2.659446 0.930293
C -2.745966 -2.116987 -0.331196
C 1.571816 -0.181566 0.265243
C -1.396574 -2.138458 -0.922983
C 0.837971 -1.111426 -0.611710
C -4.479654 -0.900462 0.980474
C 3.498020 1.356730 0.576417
C -3.190802 -0.986984 0.390676
C 2.711297 0.490202 -0.223503
C -3.664772 -3.215815 -0.469419
C 1.197706 0.050824 1.645373
C -0.939056 -2.802235 -2.033127
C 1.305673 -1.787583 -1.712640
C -5.390323 -2.011265 0.778182
C 3.138751 1.497993 1.978315
C -4.956646 -3.158267 0.076202
C 1.981363 0.866741 2.476555
C 0.447916 -2.674141 -2.514384
C -4.972844 0.278887 1.716707
C 4.678170 2.080197 0.076790
C -4.106390 1.420406 2.128443
C 5.014961 2.194918 -1.373835
C -2.777161 1.251237 2.603466
C 4.027903 2.382244 -2.380460
C -4.678573 2.722878 2.114888
C 6.388834 2.201273 -1.739001
C -2.026204 2.369506 3.024386
C 4.411250 2.544740 -3.729118
C -3.921402 3.837855 2.523541
C 6.766940 2.345825 -3.088328
C -2.590072 3.665048 2.975080
C 5.778614 2.513965 -4.088194
H -2.527315 -0.121387 0.452633
H 3.008058 0.327064 -1.262825
H -1.617761 -3.450804 -2.587623
H 2.353341 -1.698529 -2.009759
H -5.667248 -3.982862 -0.047252
H 1.711546 0.987056 3.527874
H -2.335730 0.255069 2.698473
H 2.969650 2.450962 -2.107623
H -5.715272 2.837613 1.782774
H 7.141507 2.094209 -0.951395
H -3.908270 -5.054470 -1.169363
H -0.425611 -1.042329 1.530656
H -6.814443 -1.022968 1.646984
H 4.732319 2.561332 2.292642
H -1.006895 2.221278 3.395383
H 3.645575 2.702416 -4.496099
H -4.366042 4.838341 2.495865
H 7.827255 2.333316 -3.362072
H -2.001902 4.531607 3.296512
H 6.072738 2.631242 -5.136914


