%chk=000288408.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000288408

0 1
O 1.257328 -0.422735 -1.782466
O -0.051233 0.416052 1.358486
N 2.410535 -0.048127 0.123031
N -2.784219 -0.793920 -2.172107
C 4.151691 0.176389 1.725902
C 3.787107 -0.252946 -0.473418
C 4.587749 0.806202 0.357495
C 2.593634 0.245344 1.587525
C 4.529146 -1.287538 1.471702
C 4.312166 -1.547653 0.168598
C 1.242112 -0.170138 -0.579979
C -0.091892 0.041159 0.203239
C -1.304933 -0.237940 -0.529077
C -2.640830 -0.140389 0.025604
C -3.555542 -0.493640 -1.018351
C -1.438720 -0.636105 -1.865450
C -3.140592 0.208299 1.291489
C -4.945877 -0.505760 -0.820964
C -4.513601 0.195895 1.484056
C -5.405452 -0.157091 0.440718
H 4.551143 0.636415 2.631630
H 3.789279 -0.185327 -1.569324
H 4.257250 1.840472 0.208445
H 5.669279 0.771805 0.184314
H 2.064646 -0.498817 2.213041
H 2.185310 1.244712 1.835714
H 4.879056 -1.931780 2.252625
H 4.427979 -2.455070 -0.387487
H -0.640520 -0.804441 -2.589680
H -3.162396 -1.070074 -3.059551
H -2.441618 0.479578 2.085395
H -5.626521 -0.775814 -1.621269
H -4.926990 0.462420 2.455934
H -6.475673 -0.151335 0.643381


%chk=000288408-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000288408

0 1
O 1.340438 -0.393071 -1.827036
O -0.074975 0.529825 1.358144
N 2.429982 0.061375 0.166238
N -2.789593 -0.904548 -2.133273
C 4.199431 0.110868 1.746136
C 3.799251 -0.146794 -0.462672
C 4.634323 0.820897 0.420219
C 2.633262 0.270119 1.634141
C 4.519519 -1.349431 1.396760
C 4.279252 -1.512353 0.061894
C 1.288661 -0.108030 -0.579327
C -0.062734 0.089780 0.158071
C -1.295360 -0.236178 -0.548236
C -2.644171 -0.125999 0.013465
C -3.560882 -0.553148 -1.004181
C -1.445813 -0.717888 -1.867459
C -3.157068 0.288057 1.268617
C -4.957176 -0.582022 -0.816404
C -4.553787 0.262821 1.467668
C -5.443690 -0.165742 0.441420
H 4.606978 0.497356 2.690733
H 3.751321 0.000789 -1.547012
H 4.304123 1.871734 0.345262
H 5.715709 0.739623 0.230174
H 2.077364 -0.470642 2.229993
H 2.298483 1.275264 1.937939
H 4.788102 -2.120111 2.123671
H 4.294001 -2.433430 -0.524446
H -0.659051 -0.912536 -2.591598
H -3.166515 -1.242377 -3.017383
H -2.469900 0.617360 2.051542
H -5.641349 -0.911352 -1.606214
H -4.966518 0.580124 2.431736
H -6.522818 -0.172240 0.630618


