%chk=000219457.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219457

0 1
O -1.276691 -1.589070 1.566109
O -0.577240 2.171596 -1.249345
O -0.371949 0.299758 2.339259
O -1.958154 2.269719 0.501925
C 3.002369 0.054347 -0.657854
C 3.398380 -1.379375 -0.236211
C 4.169828 0.949041 -0.180842
C 1.658691 0.513980 -0.073621
C 4.937296 -1.406708 -0.185982
C 5.423161 0.056833 -0.203389
C 0.481234 -0.234932 -0.707733
C -0.891740 0.108861 -0.076068
C -2.014987 -0.640637 -0.836102
C -3.411837 -0.434156 -0.238170
C -0.818274 -0.303180 1.394932
C -1.212469 1.601385 -0.170150
C -4.490461 -1.075787 -1.121670
C -5.883584 -0.887521 -0.526182
H 2.950710 0.100340 -1.771185
H 2.978617 -1.625812 0.754508
H 3.003711 -2.128919 -0.938540
H 3.985672 1.324747 0.841183
H 4.286538 1.835829 -0.822053
H 1.662062 0.390829 1.028644
H 1.538325 1.604129 -0.247223
H 5.290220 -1.930160 0.717781
H 5.348365 -1.962130 -1.045557
H 6.025967 0.253669 -1.106252
H 6.076613 0.271035 0.657898
H 0.642455 -1.329997 -0.639409
H 0.439308 0.005624 -1.792046
H -2.001703 -0.323463 -1.898564
H -1.776810 -1.726392 -0.833570
H -3.631696 0.644500 -0.102535
H -3.450777 -0.873986 0.779931
H -4.282112 -2.156510 -1.248482
H -4.458065 -0.637419 -2.138519
H -5.965554 -1.347449 0.465542
H -6.651581 -1.341261 -1.162582
H -6.135639 0.173789 -0.413958
H -1.199946 -1.890337 2.514059
H -0.808253 3.136691 -1.352078


%chk=000219457-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219457

0 1
O -1.250644 -1.437202 1.770248
O -0.661051 2.194130 -1.367681
O -0.583661 0.669496 2.455805
O -1.985532 2.422952 0.515594
C 3.041000 0.095618 -0.521348
C 3.414266 -1.397597 -0.304369
C 4.272041 0.832961 0.067640
C 1.699928 0.529105 0.109863
C 4.953068 -1.478116 -0.548317
C 5.491527 -0.012564 -0.391976
C 0.489951 -0.190691 -0.524788
C -0.924545 0.220508 0.025421
C -2.018780 -0.590451 -0.760298
C -3.482031 -0.358545 -0.326636
C -0.924559 -0.090399 1.528491
C -1.236930 1.708825 -0.179685
C -4.462552 -1.242376 -1.132146
C -5.933601 -1.029222 -0.715760
H 3.003333 0.295778 -1.614770
H 3.175400 -1.674907 0.743011
H 2.851334 -2.085723 -0.960918
H 4.196368 0.833053 1.174111
H 4.335410 1.887462 -0.257760
H 1.740309 0.335291 1.200203
H 1.577945 1.623065 -0.012961
H 5.434949 -2.170810 0.164984
H 5.169131 -1.862567 -1.562100
H 5.868823 0.360962 -1.362416
H 6.330275 0.049796 0.324354
H 0.582246 -1.284456 -0.382675
H 0.482985 0.002965 -1.613464
H -1.900929 -0.341957 -1.833769
H -1.771350 -1.661585 -0.640950
H -3.763566 0.705110 -0.451326
H -3.590301 -0.588274 0.751231
H -4.189353 -2.308778 -0.996068
H -4.348012 -1.026422 -2.214546
H -6.079530 -1.266421 0.354832
H -6.617282 -1.671240 -1.301002
H -6.241144 0.022242 -0.869387
H -1.156545 -1.612907 2.745800
H -0.958390 3.135392 -1.498569


