%chk=000254987.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000254987

0 1
O -4.287628 0.780367 0.427095
O -2.755511 2.392967 0.229344
O 0.462742 -1.216724 -0.778924
O 3.746359 1.412922 0.551737
N -0.740202 0.704273 -0.389623
N 2.843406 0.086393 -1.076459
N 6.048423 -0.138676 0.902253
C -2.009570 0.044385 0.017992
C -2.545505 -0.953473 -1.034550
C -1.869383 -0.770117 1.329337
C -3.402552 -1.946068 -0.233546
C -2.851833 -1.948865 1.207559
C -3.006834 1.206710 0.226872
C 0.409488 0.000734 -0.742023
C 1.603248 0.882228 -1.127256
C 3.816214 0.393724 -0.115026
C 4.990988 -0.581561 -0.031933
H -1.695494 -1.483254 -1.516342
H -3.110944 -0.460721 -1.839113
H -2.058959 -0.160390 2.226005
H -0.830776 -1.148783 1.422952
H -3.370899 -2.952497 -0.681189
H -4.461748 -1.625836 -0.236240
H -3.674056 -1.855235 1.937567
H -2.339589 -2.901053 1.430755
H -0.724624 1.731106 -0.323660
H 1.703559 1.778842 -0.460596
H 1.459204 1.272384 -2.163573
H -4.917680 1.543995 0.571879
H 2.763227 -0.853223 -1.470631
H 5.446087 -0.728066 -1.040379
H 4.631622 -1.587866 0.290322
H 5.661001 -0.007721 1.835942
H 6.413717 0.768599 0.615952


%chk=000254987-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000254987

0 1
O -4.430106 0.759905 0.137145
O -2.769963 2.369424 0.137953
O 0.541007 -1.311006 0.000776
O 4.323908 1.815373 -0.078645
N -0.784182 0.619457 0.064770
N 2.841511 0.031968 -0.029101
N 6.554875 0.048729 -0.519440
C -2.118787 -0.019769 0.085367
C -2.387089 -0.953601 -1.146511
C -2.332542 -0.982852 1.305818
C -3.465735 -1.973228 -0.690306
C -3.438250 -1.983605 0.876643
C -3.100167 1.157432 0.122116
C 0.415547 -0.041768 0.026321
C 1.652961 0.876120 0.016154
C 4.111096 0.561291 -0.063197
C 5.269382 -0.472777 -0.040412
H -1.434120 -1.467414 -1.357020
H -2.678717 -0.382617 -2.045146
H -2.574944 -0.433363 2.232090
H -1.373497 -1.506962 1.454723
H -3.250963 -2.971299 -1.111031
H -4.464310 -1.669387 -1.045468
H -4.419638 -1.671183 1.270165
H -3.222403 -2.989553 1.277598
H -0.798161 1.647597 0.083865
H 1.664120 1.523719 0.915930
H 1.624025 1.558792 -0.856669
H -5.013289 1.567008 0.161571
H 2.653454 -0.978734 -0.039004
H 4.992180 -1.366856 -0.630510
H 5.390412 -0.814134 1.006957
H 6.811818 0.914699 -0.028474
H 6.556067 0.218096 -1.532529


