%chk=000236452.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236452

0 1
O -0.367232 0.047631 -1.599577
O 0.404317 -1.897592 -0.564126
O 2.373319 -0.991968 0.276370
C 0.952369 0.556177 -1.904768
C 1.936787 -0.621354 -2.010805
C 1.768459 -1.615689 -0.861256
C -0.466467 -0.750513 -0.415902
C 1.406895 1.603180 -0.879689
C -1.883404 -1.313316 -0.413469
C 0.366545 2.715378 -0.714867
C -2.653751 -0.918135 0.849214
C 2.384203 -1.796129 1.490468
C 0.707289 3.640473 0.415064
C -4.045819 -1.480168 0.841005
C 2.755765 -0.814225 2.585622
C -0.205377 4.206919 1.202395
C -5.115391 -0.802218 1.252223
H 0.764983 1.014805 -2.903432
H 2.981515 -0.254330 -2.036234
H 1.763576 -1.157153 -2.965926
H 2.193618 -2.622655 -1.045187
H -0.141396 -0.176204 0.471155
H 1.608680 1.107750 0.097672
H 2.381257 2.025754 -1.189642
H -1.832206 -2.418830 -0.520729
H -2.415783 -0.955394 -1.323134
H -0.638664 2.259784 -0.575348
H 0.284736 3.305784 -1.652482
H -2.673319 0.187464 0.947619
H -2.125081 -1.291254 1.753371
H 3.137424 -2.591314 1.356880
H 1.382817 -2.240139 1.634394
H 1.773221 3.837102 0.546458
H -4.124415 -2.508495 0.482156
H 2.001811 -0.022062 2.683339
H 3.707901 -0.314223 2.360562
H 2.854150 -1.313909 3.555247
H 0.044091 4.886493 2.003300
H -1.268071 4.040422 1.109089
H -6.111912 -1.218760 1.259600
H -5.084236 0.216111 1.610068


%chk=000236452-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236452

0 1
O -0.570696 -0.057296 -1.355345
O 0.458682 -2.074390 -0.502139
O 2.478247 -1.009380 0.327960
C 0.735985 0.571669 -1.720657
C 1.781355 -0.546308 -1.953896
C 1.813873 -1.596208 -0.828776
C -0.463403 -0.956014 -0.214110
C 1.160239 1.665796 -0.716410
C -1.840452 -1.552049 0.049773
C 0.084048 2.769833 -0.557451
C -2.862438 -0.479215 0.509045
C 2.755628 -1.988046 1.405760
C 0.530684 3.881711 0.368228
C -4.212852 -1.077152 0.842620
C 3.448860 -1.234154 2.538966
C -0.130765 4.291563 1.479999
C -5.391399 -0.716850 0.275007
H 0.503483 1.053645 -2.688701
H 2.791813 -0.115008 -2.069940
H 1.521413 -1.079512 -2.886004
H 2.340446 -2.519258 -1.144168
H -0.065386 -0.402465 0.664823
H 1.411828 1.219735 0.261463
H 2.100025 2.118407 -1.095033
H -1.729952 -2.336733 0.822295
H -2.191243 -2.041969 -0.875697
H -0.858136 2.321399 -0.192880
H -0.135444 3.192083 -1.562112
H -2.965215 0.287592 -0.279391
H -2.456352 0.031367 1.409623
H 3.404596 -2.794662 1.000644
H 1.803751 -2.445297 1.739740
H 1.475304 4.381389 0.096401
H -4.210823 -1.868369 1.610522
H 2.798236 -0.431196 2.926923
H 4.388677 -0.776113 2.185518
H 3.685221 -1.923917 3.369737
H 0.247282 5.105487 2.109153
H -1.073543 3.822942 1.789883
H -6.337754 -1.189240 0.562349
H -5.440618 0.061380 -0.497021


