%chk=000225602.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225602

0 1
O -2.963071 1.207590 0.957980
O -0.485009 3.100234 -0.948823
O -0.528558 -3.157468 0.527965
O -2.813842 0.483770 -1.187530
O 0.596620 1.364317 -1.915968
C -0.173918 -0.345291 0.411863
C -0.794923 1.045198 0.104770
C -0.117086 -1.243310 -0.831976
C 1.184164 -0.178374 1.065316
C 0.018421 -2.704302 -0.452589
C 0.880564 -3.551234 -1.394102
C -2.278813 0.868418 -0.176696
C -0.129585 1.778829 -1.045864
C 2.319781 0.183973 0.327209
C 1.302706 -0.401384 2.446097
C 2.328456 -3.456099 -0.904902
C 0.379434 -4.994472 -1.414487
C 3.556163 0.326002 0.962162
C 2.540780 -0.258649 3.078279
C 3.669869 0.106270 2.338444
C -4.420844 1.035588 0.963336
C 0.036420 4.034651 -1.951290
C -4.761663 -0.428700 1.128669
C 1.477236 4.372207 -1.635395
H -0.864065 -0.849305 1.152699
H -0.680129 1.687003 1.030483
H -1.047256 -1.125275 -1.438032
H 0.690615 -0.908272 -1.518941
H 0.818441 -3.134837 -2.430566
H 2.238940 0.358673 -0.749275
H 0.431166 -0.697341 3.029834
H 3.006568 -3.992134 -1.578349
H 2.673326 -2.416126 -0.844308
H 2.444657 -3.898134 0.093725
H -0.616722 -5.068461 -1.864935
H 1.053450 -5.645309 -1.980715
H 0.300263 -5.400165 -0.394945
H 4.433072 0.608332 0.381866
H 2.625198 -0.435559 4.149413
H 4.633435 0.216630 2.831681
H -4.826265 1.469199 0.032192
H -4.692558 1.652888 1.839448
H -0.655290 4.886161 -1.812680
H -0.089637 3.581227 -2.950495
H -5.834785 -0.575174 1.300753
H -4.224563 -0.878515 1.974769
H -4.490878 -1.008554 0.232825
H 1.599565 4.684518 -0.589783
H 2.134908 3.504180 -1.793087
H 1.847442 5.185087 -2.271648


%chk=000225602-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000225602

0 1
O -2.861609 1.026865 0.973192
O -0.504850 3.254300 -1.011597
O -0.745864 -3.005856 0.548870
O -2.610050 0.652602 -1.319027
O 0.823297 1.553904 -1.888706
C 0.027836 -0.241849 0.399412
C -0.635244 1.152592 0.100719
C 0.092642 -1.175317 -0.836928
C 1.374057 -0.087757 1.118227
C -0.085623 -2.651909 -0.467490
C 0.579006 -3.677088 -1.396478
C -2.122785 0.936162 -0.199558
C -0.002675 1.956455 -1.039819
C 2.564049 0.282905 0.436442
C 1.439777 -0.312776 2.517711
C 2.050297 -3.864477 -0.913298
C -0.179349 -5.019523 -1.419598
C 3.781122 0.425833 1.139247
C 2.656165 -0.169704 3.222750
C 3.833683 0.201784 2.534702
C -4.317440 0.674198 0.880319
C -0.030477 4.186077 -2.084472
C -4.511935 -0.831472 1.074121
C 1.264435 4.882482 -1.658347
H -0.658815 -0.735670 1.115912
H -0.574469 1.766453 1.016523
H -0.733334 -0.936397 -1.541451
H 1.018204 -1.033493 -1.417453
H 0.611275 -3.240243 -2.415519
H 2.535460 0.470024 -0.642290
H 0.531950 -0.614221 3.054525
H 2.592299 -4.524891 -1.613687
H 2.595178 -2.904784 -0.852080
H 2.064530 -4.331651 0.087728
H -1.195475 -4.900862 -1.836908
H 0.364017 -5.760294 -2.033853
H -0.283776 -5.415564 -0.394830
H 4.689491 0.713198 0.597014
H 2.685516 -0.353728 4.302735
H 4.779457 0.311387 3.077399
H -4.694344 1.012029 -0.100804
H -4.775422 1.263192 1.690571
H -0.866450 4.894417 -2.196747
H 0.107051 3.606167 -3.013624
H -5.592325 -1.067670 1.077411
H -4.081450 -1.166841 2.032937
H -4.037653 -1.401302 0.257710
H 1.130800 5.410056 -0.698395
H 2.086910 4.155094 -1.554841
H 1.555113 5.625665 -2.423984


