%chk=000195409.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000195409

0 1
O 2.930734 2.421487 -0.827356
O 0.736442 -3.288020 -0.306477
O -1.083061 -2.624226 0.810755
O -3.148674 -1.235362 -0.719405
C 1.001762 -0.188258 0.728376
C 1.166473 1.329196 0.450338
C 2.454462 -0.710733 0.895445
C 3.351754 0.209773 0.060389
C 2.542768 1.464289 -0.207652
C 0.276465 -0.967295 -0.383194
C 0.067986 2.028119 -0.356740
C -1.286740 1.779525 0.236136
C -0.138626 -2.315314 0.117265
C -2.341494 1.423528 -0.503280
C -3.665611 1.033811 0.077920
C -4.180649 -0.252409 -0.587689
H 0.430114 -0.317524 1.677760
H 1.240131 1.843313 1.446177
H 2.546092 -1.765308 0.575390
H 2.750016 -0.689182 1.958941
H 3.648818 -0.259879 -0.897356
H 4.301683 0.453736 0.569409
H 0.113128 1.713707 -1.420125
H 0.278478 3.121903 -0.380397
H -0.649245 -0.434121 -0.717418
H 0.917008 -1.052416 -1.286481
H -1.344488 1.879518 1.319177
H -2.286053 1.345800 -1.591473
H -4.400934 1.852237 -0.069947
H -3.597896 0.893626 1.175332
H 0.473467 -4.201284 -0.010895
H -5.026298 -0.686677 -0.026055
H -4.481438 -0.082417 -1.639568
H -2.813279 -1.524743 0.164199


%chk=000195409-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000195409

0 1
O 3.013569 2.379474 -0.915945
O 0.650165 -3.389917 -0.589073
O -0.994638 -2.551558 0.805241
O -3.148245 -1.337808 -0.637135
C 0.972176 -0.170282 0.706512
C 1.176401 1.346336 0.403604
C 2.416900 -0.640823 1.076023
C 3.346033 0.134858 0.107509
C 2.578191 1.423715 -0.230059
C 0.390305 -0.979384 -0.493265
C 0.080242 2.120255 -0.373835
C -1.289333 1.865328 0.223031
C -0.073436 -2.337956 -0.023430
C -2.371230 1.444763 -0.481492
C -3.692688 1.012647 0.117320
C -4.188552 -0.315028 -0.516037
H 0.278841 -0.300289 1.556510
H 1.285944 1.836330 1.400192
H 2.535453 -1.734933 0.993496
H 2.640491 -0.359906 2.122449
H 3.516413 -0.420451 -0.835710
H 4.344207 0.370285 0.516261
H 0.089931 1.828937 -1.441301
H 0.350281 3.194296 -0.348629
H -0.507567 -0.468474 -0.884775
H 1.125614 -1.092601 -1.306397
H -1.371345 1.967084 1.317901
H -2.285046 1.337744 -1.574731
H -4.481013 1.776820 -0.052902
H -3.586568 0.902156 1.214689
H 0.284572 -4.256421 -0.258154
H -5.063913 -0.696721 0.052377
H -4.508903 -0.134350 -1.557353
H -2.729957 -1.555725 0.238610


