%chk=000195107.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195107

0 1
O 0.392533 1.562431 0.243843
O 4.912056 1.214452 -0.170690
O -5.423075 0.244674 -0.955882
C 1.869893 -0.763109 -0.499916
C 2.588616 0.550853 -0.040813
C 0.563687 -0.912761 0.281939
C -0.299345 0.329878 -0.078937
C -1.628563 0.367002 0.733415
C 2.965767 -1.836750 -0.400403
C 3.919133 0.421386 -0.836206
C 1.671069 1.726807 -0.419865
C -0.221485 -2.191092 -0.040820
C 4.264333 -1.091591 -0.793121
C -2.341742 -0.940957 0.386687
C -1.572935 -2.199426 0.696032
C 2.878014 0.618435 1.461456
C -2.449025 1.625226 0.348033
C -1.350075 0.435461 2.243686
C -3.350276 1.440145 -0.869466
C -3.537666 -0.985955 -0.216983
C -4.241526 0.226532 -0.687653
H 1.607918 -0.666827 -1.585830
H 0.783495 -0.898027 1.378257
H -0.521464 0.350265 -1.169154
H 2.766242 -2.689806 -1.066606
H 3.038262 -2.246721 0.621100
H 3.828828 0.797741 -1.874925
H 2.016968 2.692240 -0.008000
H 1.507562 1.819072 -1.504507
H 0.368879 -3.080509 0.248922
H -0.388917 -2.281466 -1.131472
H 5.058997 -1.273880 -0.048672
H 4.649750 -1.442401 -1.761633
H -1.415342 -2.286862 1.791279
H -2.147798 -3.103237 0.410917
H 3.307962 -0.312293 1.841861
H 3.609432 1.413902 1.671297
H 1.967200 0.842322 2.031113
H -1.745149 2.468232 0.175088
H -3.074716 1.937729 1.208970
H -0.742011 -0.405820 2.594594
H -0.787119 1.351092 2.479171
H -2.276725 0.443305 2.826535
H -2.753964 1.315478 -1.795021
H -3.967866 2.345923 -1.036121
H -4.060113 -1.920428 -0.422261
H 5.777503 1.115137 -0.608739


%chk=000195107-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000195107

0 1
O 0.419452 1.591587 0.426695
O 4.906623 1.355852 -0.556499
O -5.210852 0.194242 -1.596077
C 1.862750 -0.760732 -0.421222
C 2.619665 0.548952 -0.024236
C 0.554282 -0.918791 0.374854
C -0.300937 0.353442 0.079114
C -1.677113 0.367265 0.828640
C 2.959033 -1.858536 -0.373003
C 3.856706 0.406259 -0.944450
C 1.686414 1.738937 -0.326370
C -0.244929 -2.196313 0.029380
C 4.264340 -1.099743 -0.802772
C -2.369783 -0.939629 0.411905
C -1.629720 -2.218872 0.752123
C 3.046052 0.596990 1.464880
C -2.520861 1.618196 0.439150
C -1.461531 0.424197 2.370746
C -3.247349 1.503165 -0.916803
C -3.511998 -0.961967 -0.347482
C -4.103893 0.239509 -0.976977
H 1.569657 -0.644140 -1.491771
H 0.796023 -0.937581 1.455217
H -0.501943 0.365685 -1.021844
H 2.724818 -2.703199 -1.044643
H 3.059679 -2.271203 0.648330
H 3.547508 0.608777 -1.996126
H 2.105622 2.701092 0.010353
H 1.464314 1.793479 -1.416716
H 0.336558 -3.093615 0.314693
H -0.410812 -2.250330 -1.066323
H 5.044153 -1.179481 -0.023099
H 4.686794 -1.500093 -1.742349
H -1.462006 -2.310201 1.842841
H -2.211003 -3.101374 0.429935
H 3.497164 -0.352136 1.803906
H 3.798928 1.391388 1.602447
H 2.177511 0.820276 2.107407
H -1.856017 2.499720 0.448944
H -3.283175 1.774708 1.227591
H -0.814091 -0.381938 2.753891
H -0.989527 1.387154 2.631901
H -2.433683 0.355184 2.891364
H -2.514721 1.454240 -1.749221
H -3.888438 2.381387 -1.107587
H -4.003020 -1.914669 -0.586397
H 5.680557 1.248658 -1.163841


