%chk=000209020.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209020

0 1
I 0.242061 -2.734160 0.998004
I -0.084355 3.269903 0.336457
I 5.151017 0.294319 -0.706637
O -0.890220 0.644201 0.794564
O -3.097774 -2.100232 -0.092848
O -1.844722 -0.831854 -1.452009
O 3.163873 3.250520 -1.639633
O 3.270162 -2.881813 -0.916627
N 3.695525 3.495711 0.577700
N 3.883639 -2.537452 1.265994
C -4.300621 -0.153569 1.948020
C -5.540318 0.731817 2.129495
C -3.131154 0.618606 1.330718
C -6.244809 1.074677 0.809751
C -1.969759 -0.319121 0.975971
C -6.966350 -0.134153 0.197550
C -2.232932 -1.052469 -0.336309
C -7.641772 0.221009 -1.124700
C 0.406109 0.325140 0.505948
C 1.104160 -0.885521 0.507975
C 1.093937 1.535925 0.215555
C 2.467531 -0.882976 0.160807
C 2.432740 1.532635 -0.122938
C 3.121414 0.306348 -0.150793
C 3.126658 2.831479 -0.501214
C 3.232713 -2.198559 0.086044
C 4.409284 4.772806 0.378408
C 4.687820 -3.772931 1.347874
H -4.555145 -1.028746 1.309025
H -4.001362 -0.575002 2.927176
H -5.259588 1.669441 2.648294
H -6.252220 0.220741 2.808187
H -3.460689 1.181569 0.431323
H -2.758618 1.398447 2.030055
H -6.972527 1.890917 0.985024
H -5.512493 1.480026 0.083923
H -1.716225 -1.021490 1.803854
H -6.244047 -0.960033 0.039287
H -7.718976 -0.523796 0.910261
H -8.157227 -0.646339 -1.552150
H -6.916012 0.569231 -1.868940
H -8.386593 1.014947 -0.998826
H -3.307800 -2.615674 -0.919102
H 3.652794 3.134644 1.521518
H 3.852755 -1.952337 2.090313
H 4.385320 5.068184 -0.691208
H 5.466168 4.679671 0.678209
H 3.933486 5.578726 0.961172
H 4.300389 -4.436474 2.138273
H 4.646052 -4.327530 0.387368
H 5.745101 -3.537209 1.553833


%chk=000209020-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000209020

0 1
I 0.122701 -2.217453 2.413979
I -0.046262 3.032966 -0.741131
I 5.173276 -0.273402 -0.548556
O -0.990283 0.505263 0.944117
O -1.269909 -0.269564 -1.957638
O -3.254755 0.862828 -1.508299
O 3.115719 2.030311 -2.633657
O 3.180043 -3.317695 0.499141
N 3.669872 3.219859 -0.699930
N 3.848155 -2.149545 2.409665
C -4.414472 -1.217502 0.778131
C -5.649946 -1.152999 1.711729
C -3.285823 -0.247866 1.201705
C -6.337979 0.233694 1.799318
C -2.055438 -0.358911 0.306706
C -6.806282 0.802091 0.438385
C -2.299651 0.160241 -1.118902
C -7.596276 2.120039 0.592615
C 0.350437 0.289562 0.601737
C 1.087283 -0.824011 1.084901
C 1.042964 1.281794 -0.143954
C 2.455877 -1.003401 0.764056
C 2.411866 1.140811 -0.474299
C 3.097432 -0.016001 -0.024858
C 3.095765 2.163207 -1.375322
C 3.193596 -2.265083 1.200707
C 4.345416 4.322565 -1.394032
C 4.603488 -3.258660 3.003893
H -4.725590 -0.993936 -0.259377
H -4.023895 -2.256341 0.779023
H -5.349519 -1.471508 2.731576
H -6.391688 -1.897292 1.356642
H -3.645492 0.795793 1.174778
H -2.966287 -0.469194 2.237354
H -7.216258 0.146599 2.471882
H -5.658793 0.965517 2.282540
H -1.680745 -1.397537 0.242487
H -5.932079 0.975371 -0.219118
H -7.439384 0.046872 -0.071817
H -7.921726 2.513842 -0.387757
H -6.975939 2.897451 1.078100
H -8.498428 1.973242 1.216792
H -1.365570 0.127735 -2.865675
H 3.585473 3.249481 0.317675
H 3.800832 -1.257193 2.904476
H 4.359947 4.081316 -2.468568
H 5.384296 4.437930 -1.036008
H 3.802498 5.274959 -1.249403
H 4.209721 -3.512621 4.004814
H 4.490904 -4.131664 2.341837
H 5.677308 -3.009759 3.087535


