%chk=000294504.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294504

0 1
O 2.331598 0.530751 -2.373482
O -2.322237 -0.534748 2.384763
O 4.173768 -1.300648 1.157159
O -4.165941 1.296557 -1.145131
N 1.381115 0.290810 -0.321145
N -1.373653 -0.296618 0.331313
C 1.054985 -0.532674 0.870749
C 0.302111 1.253328 -0.683429
C -0.294659 -1.259237 0.693383
C -1.047456 0.526638 -0.860727
C 2.282715 -0.092930 -1.324542
C -2.273932 0.088412 1.335514
C 3.252768 -1.217184 -1.029054
C -3.243370 1.213255 1.040402
C 4.262154 -0.835376 0.044642
C -4.254050 0.832009 -0.032273
C 5.330504 0.118345 -0.375869
C -5.323405 -0.119952 0.389604
H 1.011741 0.148875 1.754029
H 1.865398 -1.262731 1.098509
H 0.577155 1.785529 -1.627573
H 0.240821 2.020960 0.118344
H -0.233439 -2.026714 -0.108545
H -0.569684 -1.791604 1.637428
H -1.857958 1.256515 -1.088764
H -1.004094 -0.155145 -1.743823
H 3.780340 -1.473610 -1.976657
H 2.716205 -2.144622 -0.738340
H -2.706289 2.140163 0.748829
H -3.769887 1.470469 1.988386
H 6.112982 -0.386669 -0.961673
H 5.828966 0.575519 0.493108
H 4.943067 0.933731 -1.007523
H -4.936642 -0.935514 1.021449
H -5.823132 -0.576979 -0.478732
H -6.104764 0.386491 0.975676


%chk=000294504-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000294504

0 1
O 2.615259 0.701616 -2.325828
O -2.607350 -0.705757 2.337298
O 4.302685 -1.172740 1.241064
O -4.294585 1.168602 -1.229663
N 1.350075 0.129814 -0.455635
N -1.342092 -0.133886 0.467176
C 1.068385 -0.626917 0.785152
C 0.370228 1.204684 -0.737486
C -0.362244 -1.208755 0.749032
C -1.060401 0.622845 -0.773610
C 2.417893 -0.056516 -1.324016
C -2.409934 0.052422 1.335533
C 3.398337 -1.212934 -1.024483
C -3.390413 1.208797 1.035953
C 4.422223 -0.789256 0.046353
C -4.414204 0.785099 -0.034966
C 5.542021 0.119471 -0.424692
C -5.533963 -0.123737 0.435960
H 1.156694 0.061451 1.649610
H 1.810657 -1.423619 0.936600
H 0.635112 1.657619 -1.706460
H 0.441979 1.980207 0.051545
H -0.433994 -1.984283 -0.039994
H -0.627131 -1.661686 1.718008
H -1.802672 1.419549 -0.925053
H -1.148707 -0.065518 -1.638072
H 3.911111 -1.408499 -1.980010
H 2.883266 -2.127364 -0.689970
H -2.875363 2.123258 0.701494
H -3.903265 1.404319 1.991448
H 6.279169 -0.474817 -0.999789
H 6.054469 0.582293 0.432573
H 5.151900 0.891644 -1.112737
H -5.143834 -0.895904 1.124008
H -6.046305 -0.586571 -0.421363
H -6.271204 0.470469 1.011022


