%chk=000248112.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248112

0 1
O -5.138033 -2.139833 -0.820534
O -5.027676 1.853801 1.506147
N -2.996309 1.007381 0.835661
N -5.090535 -0.144399 0.333830
N -2.055761 -1.945083 -0.971861
N -0.947126 -0.155849 -0.020097
N 0.394628 -1.984229 -1.079322
N 1.653319 -1.429989 -1.023777
C -3.028700 -1.100674 -0.390939
C -2.319434 -0.015266 0.183220
C -4.461497 -1.244616 -0.357692
C -4.428467 0.965775 0.930920
C -0.814365 -1.345078 -0.717250
C 3.395476 -0.011935 -0.232403
C -2.252073 2.138597 1.439714
C 4.347787 -0.757057 0.492164
C 3.783493 1.161250 -0.912969
C -6.576671 -0.140702 0.435256
C 6.063855 0.853578 -0.126507
C 5.676596 -0.315112 0.542960
C 5.115483 1.587410 -0.854127
C 1.974329 -0.425794 -0.264409
C 3.948618 -2.006308 1.206918
C 2.780161 1.941305 -1.699019
C 7.486496 1.309248 -0.080967
H -2.268183 -2.823062 -1.412512
H -2.956876 2.837301 1.931824
H -1.691560 2.686579 0.662028
H -1.535112 1.766236 2.192922
H -6.968942 -1.154413 0.227772
H -7.010110 0.561902 -0.296569
H -6.894536 0.168707 1.446809
H 6.412705 -0.886516 1.102616
H 5.417506 2.490205 -1.378473
H 0.334466 -2.611174 -1.899871
H 1.304415 0.186966 0.366047
H 3.115646 -1.826906 1.901701
H 3.607465 -2.772399 0.491303
H 4.767796 -2.447276 1.787985
H 3.196941 2.861836 -2.127161
H 2.387361 1.344338 -2.536357
H 1.918741 2.233701 -1.080497
H 8.046233 0.912170 -0.941443
H 7.574838 2.403411 -0.114521
H 8.006315 0.972574 0.825779


%chk=000248112-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248112

0 1
O -5.189806 -2.333339 0.110926
O -4.948983 2.388156 0.154851
N -2.923179 1.203430 0.087726
N -5.047669 0.045564 0.132572
N -2.088551 -2.252169 0.029664
N -0.936597 -0.272612 0.020660
N 0.329762 -2.383821 -0.032384
N 1.678983 -2.001856 -0.059863
C -3.045749 -1.221605 0.065182
C -2.305100 -0.034721 0.058545
C -4.476132 -1.281034 0.102263
C -4.341730 1.279389 0.126732
C -0.835283 -1.638166 0.004352
C 3.360706 -0.207919 -0.081289
C -2.127739 2.445673 0.079773
C 4.531733 -1.044443 -0.113622
C 3.524523 1.224279 -0.070034
C -6.523588 0.157075 0.174208
C 5.982744 0.968976 -0.129693
C 5.808013 -0.434808 -0.134709
C 4.821824 1.778831 -0.092766
C 1.980636 -0.706800 -0.053447
C 4.466577 -2.559261 -0.120926
C 2.334229 2.174718 -0.029452
C 7.367351 1.587802 -0.185639
H -2.317847 -3.245256 0.026387
H -2.832356 3.289487 0.104970
H -1.509195 2.494828 -0.832438
H -1.465225 2.478376 0.961377
H -6.927478 -0.866044 0.173621
H -6.886331 0.717327 -0.703030
H -6.837379 0.696897 1.082596
H 6.695019 -1.080761 -0.155504
H 4.931627 2.870531 -0.080547
H 0.242141 -3.398567 -0.040373
H 1.179769 0.040231 -0.027772
H 3.932060 -2.945689 0.765084
H 3.899203 -2.935987 -0.990267
H 5.483717 -2.988045 -0.142267
H 2.681127 3.221667 -0.026430
H 1.668231 2.046143 -0.903648
H 1.712955 2.026114 0.874034
H 7.665964 1.797031 -1.231755
H 7.405803 2.545937 0.362363
H 8.129919 0.915042 0.244269


