%chk=000194267.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194267

0 1
O 1.876030 -0.639160 0.138627
O 0.957161 1.419897 0.233690
O 5.579224 1.133320 -0.594757
O 5.325235 -1.790951 -0.342013
O 3.431614 1.896323 0.806692
O 1.829066 -3.699499 -0.029520
O -2.829262 -1.439185 -0.405105
O -4.504966 -2.815545 -0.753069
C 4.371998 0.441356 -0.850884
C 4.293843 -0.867699 -0.027432
C 3.178619 1.370458 -0.493965
C 2.926982 -1.551220 -0.277917
C 1.835608 0.609079 -0.568244
C 2.713875 -2.784517 0.612972
C -0.370941 1.066061 0.357471
C -0.935696 -0.102674 -0.127164
C -1.125363 2.053313 1.047472
C -3.116814 0.671843 0.759888
C -2.318196 -0.283971 0.083441
C -2.475420 1.842870 1.238538
C -4.530689 0.389788 0.923227
C -5.041595 -0.771511 0.429098
C -5.401654 1.372074 1.627344
C -4.248820 -1.755895 -0.257539
H 4.425161 0.236544 -1.945014
H 4.456424 -0.668526 1.059069
H 3.175489 2.278697 -1.145084
H 2.774534 -1.812324 -1.347476
H 1.429672 0.459086 -1.586128
H 3.659515 -3.362785 0.709878
H 2.326525 -2.503888 1.609060
H 5.553062 1.545415 0.312759
H 5.595080 -1.734338 -1.283910
H 2.899105 1.411627 1.488299
H 0.905763 -3.361014 0.000406
H -0.358156 -0.885001 -0.617197
H -0.621702 2.948373 1.408199
H -3.065869 2.594094 1.768351
H -6.098713 -1.028044 0.527212
H -6.452452 1.048502 1.682703
H -5.400597 2.349977 1.120951
H -5.069077 1.536351 2.664372


%chk=000194267-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000194267

0 1
O 2.063807 -0.649988 0.546154
O 0.970477 1.424876 0.539991
O 5.564252 1.057443 -1.039001
O 5.186069 -1.864725 -1.088839
O 3.752094 1.750885 0.952449
O 1.596443 -3.464655 0.697701
O -2.843835 -1.429018 -0.473585
O -4.625059 -2.800479 -1.003620
C 4.245237 0.416543 -1.030191
C 4.343355 -0.952859 -0.320041
C 3.206236 1.339753 -0.349635
C 2.955091 -1.602446 -0.189548
C 1.868752 0.592877 -0.217379
C 2.940342 -2.893781 0.629687
C -0.401915 1.096391 0.573772
C -0.952122 -0.075718 0.021216
C -1.220731 2.063059 1.216290
C -3.208970 0.689495 0.734483
C -2.349567 -0.257618 0.100181
C -2.602196 1.852346 1.293089
C -4.642029 0.413258 0.777014
C -5.120540 -0.749043 0.200703
C -5.583902 1.390356 1.444716
C -4.276735 -1.737710 -0.458707
H 3.992603 0.254443 -2.094525
H 4.765025 -0.786348 0.696574
H 3.070410 2.263940 -0.937924
H 2.527077 -1.794863 -1.196676
H 1.449840 0.351925 -1.220837
H 3.568620 -3.646574 0.130396
H 3.349940 -2.691650 1.642833
H 5.667230 1.495625 -0.149754
H 6.020316 -1.374801 -1.313416
H 3.278015 1.263311 1.674494
H 0.997309 -2.790967 1.111382
H -0.347541 -0.858957 -0.441248
H -0.750798 2.957738 1.632783
H -3.228008 2.601100 1.788101
H -6.187488 -0.987997 0.211959
H -6.626285 1.038720 1.388174
H -5.531479 2.386447 0.966376
H -5.325737 1.526966 2.511708


