%chk=000230395.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230395

0 1
O -0.040017 -1.921020 0.429186
O 0.269695 1.625724 -0.049139
O 2.062705 -0.254987 -0.962535
O -2.680044 0.393760 -0.731662
O 2.502676 0.333411 2.526658
O -1.714287 0.138395 2.699954
O 3.419255 1.381023 0.767159
O -3.178297 -1.102041 1.534505
O -0.140385 -2.558782 2.599452
O 0.463686 1.705824 -2.311686
O 3.361286 -2.067197 -1.358277
O -3.905767 2.245156 -0.289845
C 0.437230 -0.597014 0.785275
C -0.411826 0.345697 -0.096698
C 1.939872 -0.585468 0.432220
C -1.834412 0.656442 0.411189
C 2.707483 0.501904 1.181617
C -2.352712 -0.227498 1.540190
C -0.313393 -2.842142 1.441731
C 0.750172 2.179091 -1.241047
C 2.803647 -1.098103 -1.801197
C -3.727244 1.282422 -0.990448
C -0.819869 -4.080765 0.805871
C 1.583999 3.350619 -0.887985
C 2.709023 -0.537308 -3.167997
C -4.448717 0.796458 -2.190849
H 0.299741 -0.412371 1.887700
H -0.455249 -0.036440 -1.154407
H 2.399589 -1.592504 0.636460
H -1.914187 1.740001 0.717000
H -1.919598 -4.142704 0.906608
H -0.394598 -4.977095 1.285671
H -0.594991 -4.128283 -0.273557
H 1.150136 3.949769 -0.071370
H 1.747562 4.007759 -1.754551
H 2.579917 3.013203 -0.522849
H 2.979663 1.008981 3.083822
H -1.957475 -0.436843 3.481125
H 1.926851 0.250226 -3.246522
H 2.467775 -1.320586 -3.903904
H 3.661818 -0.075406 -3.474696
H -4.452346 1.562051 -2.984530
H -5.500949 0.569555 -1.948297
H -4.001015 -0.121114 -2.611647


%chk=000230395-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230395

0 1
O 0.042209 -1.958442 0.386548
O 0.182985 1.616938 -0.284979
O 2.251668 -0.377709 -0.807373
O -2.624379 1.199080 -0.677199
O 1.858236 1.170898 2.455299
O -2.257902 -0.931027 2.249352
O 3.259679 1.722644 0.683451
O -3.434923 -1.354283 0.282557
O 0.831451 -2.763492 2.430305
O 0.283167 1.309407 -2.610917
O 2.900546 -2.619709 -0.661820
O -4.291990 1.799725 0.834432
C 0.391286 -0.575462 0.806587
C -0.476317 0.304925 -0.123236
C 1.911187 -0.364402 0.621283
C -1.884136 0.589987 0.441617
C 2.421399 0.957892 1.195080
C -2.625781 -0.666810 0.928624
C 0.362403 -2.994003 1.296854
C 0.536010 2.005118 -1.611549
C 2.733834 -1.590034 -1.348421
C -3.870715 1.770426 -0.340800
C 0.090902 -4.335738 0.669619
C 1.254989 3.328247 -1.567347
C 3.005666 -1.408444 -2.820023
C -4.563949 2.278967 -1.578579
H 0.150722 -0.447345 1.875726
H -0.561479 -0.175851 -1.114818
H 2.431981 -1.194301 1.141184
H -1.819733 1.296137 1.288498
H -0.825060 -4.311583 0.057912
H 0.020083 -5.109061 1.448600
H 0.938578 -4.577692 0.001774
H 0.680115 4.063276 -0.979591
H 1.415291 3.699778 -2.589515
H 2.229515 3.187099 -1.064942
H 2.224490 2.008223 2.848379
H -2.723961 -1.744407 2.582737
H 2.175135 -0.859630 -3.294292
H 3.151069 -2.387983 -3.297398
H 3.919517 -0.801529 -2.952846
H -5.330233 3.017431 -1.300880
H -5.056904 1.430105 -2.086821
H -3.840248 2.714436 -2.285375


