%chk=000221471.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221471

0 1
O -5.439688 -0.545882 -0.399111
O -6.016787 -1.065758 1.752580
C 3.319910 -0.084361 -0.051591
C 4.746372 0.475044 0.034503
C 2.272104 1.030692 0.067382
C 5.794060 -0.640121 -0.084246
C 0.847525 0.469182 -0.019584
C 7.220448 -0.080961 0.001423
C -0.204631 1.583591 0.099751
C 8.269543 -1.195551 -0.117196
C -1.594969 1.017321 0.011614
C 9.691351 -0.644695 -0.032565
C -2.223944 0.882017 -1.239498
C -2.268858 0.610649 1.172210
C -3.508998 0.353731 -1.334031
C -3.559588 0.077448 1.104515
C -4.156084 -0.040152 -0.150976
C -6.295251 -1.031509 0.583554
C -7.541410 -1.464998 -0.106638
H 3.161903 -0.836148 0.745802
H 3.185634 -0.627111 -1.007212
H 4.905170 1.226435 -0.762855
H 4.881286 1.017160 0.990320
H 2.431340 1.782555 -0.729512
H 2.406932 1.572279 1.023610
H 5.659364 -1.182787 -1.039749
H 5.635897 -1.391360 0.713457
H 0.709179 -0.073304 -0.975134
H 0.684996 -0.282995 0.777099
H 7.356905 0.461662 0.956522
H 7.380424 0.670333 -0.795562
H -0.044239 2.342337 -0.692868
H -0.068955 2.130877 1.054777
H 8.135532 -1.738174 -1.073420
H 8.112021 -1.946957 0.681170
H 9.893593 0.075336 -0.833588
H 10.432583 -1.447070 -0.117840
H 9.869888 -0.133046 0.919995
H -1.702331 1.191342 -2.144654
H -1.785276 0.707432 2.144237
H -4.012326 0.242488 -2.291522
H -4.079858 -0.237103 2.012463
H -7.499943 -1.306602 -1.197237
H -8.412314 -0.911154 0.279576
H -7.730712 -2.536213 0.069528


%chk=000221471-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221471

0 1
O -5.562794 -0.582230 -0.422830
O -6.272263 -0.959006 1.793338
C 3.371598 -0.077244 -0.084731
C 4.814484 0.461361 0.044338
C 2.293799 1.018459 0.075602
C 5.893436 -0.632853 -0.119211
C 0.852575 0.474797 -0.038414
C 7.336332 -0.096039 0.016154
C -0.224939 1.584507 0.117935
C 8.415374 -1.190599 -0.148819
C -1.643157 1.044346 0.020612
C 9.853654 -0.645410 -0.012983
C -2.263472 0.846336 -1.241744
C -2.372242 0.682608 1.180196
C -3.560034 0.305580 -1.339446
C -3.675257 0.137477 1.112499
C -4.258141 -0.046622 -0.162661
C -6.478685 -1.000471 0.561917
C -7.743186 -1.504087 -0.101557
H 3.206596 -0.867682 0.677061
H 3.250586 -0.568897 -1.072661
H 4.979055 1.254366 -0.715177
H 4.935758 0.949987 1.033903
H 2.452281 1.804709 -0.692431
H 2.421030 1.516621 1.059790
H 5.774968 -1.118960 -1.110400
H 5.726483 -1.427838 0.637736
H 0.718449 -0.026083 -1.018712
H 0.684672 -0.303486 0.733227
H 7.456728 0.388582 1.007874
H 7.504953 0.699530 -0.739878
H -0.055486 2.352330 -0.663208
H -0.076744 2.085189 1.094827
H 8.293654 -1.674928 -1.139334
H 8.246868 -1.984593 0.607386
H 10.059551 0.125076 -0.780053
H 10.605260 -1.447893 -0.129902
H 10.008186 -0.179315 0.978687
H -1.727632 1.124090 -2.157488
H -1.917282 0.831593 2.167182
H -4.045737 0.154225 -2.308260
H -4.220894 -0.130573 2.017314
H -7.676967 -1.442498 -1.196623
H -8.601972 -0.908682 0.254615
H -7.921649 -2.549879 0.203830


