%chk=000256215.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256215

0 1
O 2.853245 1.808737 -2.098506
O 4.070653 -1.025579 1.859819
O -2.955460 -0.668372 0.160563
O -1.679923 1.645484 -0.634300
O -1.736507 -2.384764 -0.674736
O -0.504013 1.655108 1.294373
N 1.842929 -0.359598 -0.163933
C 2.117911 1.071050 0.106790
C 3.035049 -1.233404 -0.338886
C 0.607094 -0.925572 -0.214322
C 1.821371 1.952367 -1.117635
C 3.424849 -1.939482 0.973768
C -0.635305 -0.349010 -0.049176
C -1.776843 -1.246744 -0.241853
C -0.904043 1.039289 0.324858
C -4.176805 -1.466679 0.039288
C -2.193611 2.986886 -0.361122
C -4.257693 -2.456568 1.182677
C -1.115239 4.023694 -0.602421
H 3.190558 1.194842 0.393071
H 1.519447 1.420426 0.991108
H 3.896263 -0.610828 -0.688271
H 2.850324 -1.985098 -1.138805
H 0.600242 -2.019663 -0.448574
H 1.881358 3.026273 -0.846496
H 0.833505 1.741174 -1.568742
H 4.208128 -2.703520 0.789739
H 2.560131 -2.410164 1.474098
H 2.740131 0.971997 -2.592018
H 3.411606 -0.435369 2.285672
H -4.181559 -1.956834 -0.950444
H -4.943344 -0.672281 0.092348
H -2.581136 3.010608 0.672901
H -3.021331 3.040767 -1.092322
H -3.489199 -3.238115 1.082275
H -4.094580 -1.965785 2.151001
H -5.233496 -2.953546 1.216673
H -0.319041 3.945814 0.152264
H -0.655405 3.906869 -1.591254
H -1.521861 5.040788 -0.544671


%chk=000256215-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256215

0 1
O 2.752158 1.213150 -2.600150
O 3.782070 -0.731720 2.169943
O -2.938459 -0.695957 0.102975
O -1.795200 1.800085 -0.366733
O -1.612668 -2.296121 -0.959477
O -0.199711 1.682360 1.326822
N 1.937697 -0.353319 -0.177361
C 2.298103 1.090026 -0.147032
C 3.057866 -1.333746 -0.145502
C 0.663407 -0.849487 -0.232729
C 1.985676 1.789756 -1.486321
C 3.359010 -1.823102 1.287331
C -0.593420 -0.249399 -0.113373
C -1.722507 -1.169247 -0.394811
C -0.823738 1.128431 0.372956
C -4.125293 -1.573079 -0.120059
C -2.204221 3.147434 0.132821
C -4.248046 -2.619387 0.992037
C -1.311733 4.243967 -0.456991
H 3.382046 1.149440 0.041101
H 1.763798 1.603174 0.674151
H 3.953154 -0.848260 -0.568347
H 2.805012 -2.204484 -0.781871
H 0.617290 -1.924057 -0.462409
H 2.318833 2.838936 -1.420175
H 0.899347 1.779551 -1.704083
H 4.212793 -2.521695 1.263634
H 2.474907 -2.354685 1.697848
H 2.349554 0.343130 -2.848894
H 2.995349 -0.177523 2.406670
H -4.029645 -2.053131 -1.109850
H -4.971418 -0.866872 -0.117981
H -2.158079 3.144337 1.236016
H -3.248786 3.240628 -0.205438
H -3.402126 -3.325657 0.955136
H -4.271137 -2.137016 1.984657
H -5.185127 -3.193092 0.864134
H -0.279308 4.153053 -0.079554
H -1.299747 4.191036 -1.559659
H -1.699300 5.237738 -0.164635


