%chk=000216909.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216909

0 1
O -3.702881 -0.523644 -0.138421
O 5.104032 1.074879 0.214790
O 1.247746 -1.387041 -0.149920
O -7.123364 0.230184 -0.111926
O -6.059198 -1.652326 -0.316124
N 2.602050 -1.597287 -0.150190
N -0.283269 0.502332 0.047170
N -6.112569 -0.447930 -0.173837
C 3.221896 -0.408094 0.003030
C 4.653496 -0.254076 0.047505
C 2.233516 0.650842 0.111198
C -2.636123 0.381818 -0.010762
C 1.018994 0.016273 0.013199
C 5.726201 -1.111870 -0.035651
C -3.101347 1.674768 0.134831
C -4.849040 0.278207 -0.063963
C -4.530528 1.610373 0.100775
C -1.328224 -0.263221 -0.063564
C 6.912322 -0.304948 0.082418
C 6.497143 0.993680 0.230398
H 2.444277 1.698477 0.240201
H -2.501643 2.564484 0.251985
H 5.698837 -2.179762 -0.163981
H -5.217107 2.439389 0.186955
H -1.349291 -1.362771 -0.195286
H 7.919222 -0.677704 0.056058
H 6.968252 1.944567 0.352809


%chk=000216909-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000216909

0 1
O -3.746081 -0.558514 -0.145151
O 5.145851 1.103356 0.216790
O 1.251694 -1.416683 -0.148989
O -7.191023 0.412556 -0.094465
O -6.222583 -1.663388 -0.326762
N 2.688602 -1.636748 -0.148876
N -0.269627 0.485895 0.046255
N -6.166420 -0.383043 -0.170763
C 3.232423 -0.386348 0.006972
C 4.670603 -0.219840 0.052132
C 2.230088 0.636801 0.108715
C -2.645000 0.321740 -0.017268
C 1.005528 -0.014249 0.010518
C 5.749180 -1.092473 -0.031978
C -3.113417 1.638526 0.133499
C -4.879164 0.246992 -0.069355
C -4.539648 1.590220 0.100241
C -1.339210 -0.284150 -0.065706
C 6.948108 -0.297262 0.083013
C 6.547348 1.021536 0.231813
H 2.394059 1.702201 0.236133
H -2.476343 2.511405 0.251739
H 5.679992 -2.170322 -0.160329
H -5.244922 2.412234 0.186579
H -1.301280 -1.378673 -0.196208
H 7.974089 -0.657659 0.058583
H 7.070553 1.965487 0.352564


