%chk=000297874.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297874

0 1
O 0.966723 -1.220026 -1.331748
O -3.927278 -2.798855 0.278729
O 0.487158 -1.911444 0.810514
N -1.173501 -1.145779 -0.633515
N -2.539504 2.179902 0.654736
N -2.264843 3.206118 -1.348215
N -2.001221 -3.343159 1.361383
C -2.224619 -1.056266 0.407008
C -3.363366 -0.122642 -0.042828
C -2.899916 1.249935 -0.338484
C -2.807941 -2.479950 0.638198
C -2.723119 1.905708 -1.562675
C 0.132662 -1.444913 -0.261660
C -2.156093 3.361949 -0.011374
C 2.392060 -1.508463 -1.124999
C 3.055129 -0.328808 -0.476357
C 3.047466 -0.205700 0.921372
C 3.681891 0.649318 -1.261084
C 3.676557 0.883118 1.529004
C 4.310320 1.737327 -0.647956
C 4.310720 1.853681 0.745637
H -1.779310 -0.685605 1.371491
H -4.163019 -0.124585 0.734160
H -3.879058 -0.557725 -0.935406
H -1.357123 -0.700244 -1.535194
H -2.556691 2.018198 1.643272
H -2.902769 1.536822 -2.557037
H 2.712511 -1.682052 -2.170572
H 2.489966 -2.437995 -0.533066
H -1.825489 4.252732 0.500242
H -1.017770 -3.143688 1.539669
H -2.289802 -4.303800 1.481589
H 2.535798 -0.958386 1.528290
H 3.675809 0.568595 -2.347223
H 3.672597 0.975955 2.613759
H 4.797011 2.496619 -1.258191
H 4.802457 2.701009 1.220830


%chk=000297874-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000297874

0 1
O 0.933993 -1.155017 -1.286708
O -4.056703 -2.857825 0.211735
O 0.406754 -1.971648 0.864762
N -1.213516 -1.042357 -0.548413
N -2.353965 2.133797 0.495513
N -2.508216 3.214910 -1.482982
N -2.015616 -3.425358 1.188340
C -2.315432 -1.096869 0.433146
C -3.458173 -0.136334 0.011507
C -2.998969 1.239477 -0.378112
C -2.888646 -2.546841 0.590756
C -3.081044 1.935004 -1.590575
C 0.063083 -1.427183 -0.232785
C -2.077767 3.302278 -0.211104
C 2.386912 -1.469798 -1.037381
C 3.110082 -0.303102 -0.401710
C 3.225142 -0.211431 1.009611
C 3.684597 0.710583 -1.210340
C 3.903707 0.877413 1.600635
C 4.360542 1.801382 -0.620407
C 4.472821 1.885539 0.787319
H -1.896286 -0.801522 1.416578
H -4.188811 -0.107032 0.840900
H -3.999849 -0.592137 -0.834988
H -1.371027 -0.567743 -1.441201
H -2.121313 1.950909 1.471221
H -3.530226 1.598859 -2.523260
H 2.759546 -1.684908 -2.050891
H 2.431922 -2.373552 -0.406318
H -1.576340 4.160769 0.229273
H -1.048322 -3.131441 1.391853
H -2.305064 -4.397167 1.301780
H 2.768564 -0.988463 1.632721
H 3.597815 0.646228 -2.301908
H 3.991808 0.938868 2.691118
H 4.800837 2.579771 -1.253269
H 5.001562 2.728843 1.245885


