%chk=000258569.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258569

0 1
O -2.627509 -2.493210 0.000254
O -0.769645 3.505679 -0.000195
O 2.216415 -2.843185 0.000183
O 1.391426 3.341871 0.000787
O 3.460238 -1.068196 -0.000874
N 0.270654 2.871287 0.000224
N 2.385723 -1.639116 -0.000245
C -1.249413 -0.583355 0.000064
C 0.152930 1.391672 0.000122
C 1.169688 -0.784850 -0.000110
C -0.097190 -1.387348 -0.000052
C -1.126772 0.807949 0.000147
C 1.314047 0.609372 -0.000018
C -2.585425 -1.284339 0.000105
C -3.815122 -0.434624 0.000314
H -0.192443 -2.488858 -0.000076
H -2.009361 1.463591 0.000233
H 2.314653 1.076311 -0.000049
H -3.883425 0.208417 -0.888357
H -3.883021 0.208651 0.888842
H -4.722647 -1.065018 0.000599


%chk=000258569-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000258569

0 1
O -2.658298 -2.545300 0.001825
O -0.811020 3.563720 0.000359
O 2.236079 -2.914354 0.000671
O 1.463004 3.380861 0.002497
O 3.538024 -1.040927 0.002300
N 0.279537 2.876156 -0.000300
N 2.396868 -1.637923 0.000598
C -1.258965 -0.593376 -0.002492
C 0.156745 1.389420 -0.000711
C 1.170363 -0.784383 -0.000306
C -0.092597 -1.400976 -0.001563
C -1.130923 0.815080 -0.001931
C 1.330618 0.615432 0.000160
C -2.608029 -1.285092 -0.004297
C -3.866770 -0.434717 0.001152
H -0.189173 -2.491155 -0.002019
H -1.998917 1.479447 -0.002532
H 2.321222 1.076953 0.001133
H -3.912276 0.219007 -0.890136
H -3.904809 0.219485 0.892464
H -4.746884 -1.094657 0.005028