%chk=000242934.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242934

0 1
O 4.895893 0.390762 -1.175814
O 0.259866 0.494052 2.874192
O -4.031805 -0.330111 -1.664682
N 2.785563 -0.395270 0.577259
N -0.021876 -0.472471 0.772102
N -1.337295 -0.114893 0.696996
C 3.139118 1.053064 0.395233
C 4.009417 -1.248654 0.412836
C 3.740831 1.237078 -1.006406
C 4.585801 -1.003861 -0.991920
C 2.164192 -0.619031 1.917502
C 0.716917 -0.109218 1.934581
C -2.003529 -0.374644 -0.398945
C -3.405447 -0.004651 -0.437784
C -4.309320 0.588690 0.410179
C -5.565077 0.648682 -0.294321
C -5.357620 0.090572 -1.528412
H 3.853078 1.423614 1.162935
H 2.212114 1.659211 0.493545
H 3.716229 -2.314589 0.519145
H 4.787890 -1.039934 1.178611
H 3.009258 1.013366 -1.802431
H 4.164347 2.247632 -1.148077
H 5.570218 -1.486565 -1.126883
H 3.888038 -1.327084 -1.784344
H 2.150624 -1.708533 2.152799
H 2.706005 -0.130035 2.760956
H 0.480323 -0.889743 -0.028877
H -1.624397 -0.851585 -1.316447
H -4.124524 0.943204 1.408807
H -6.474366 1.059546 0.100737
H -5.946568 -0.099801 -2.397171


%chk=000242934-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242934

0 1
O 4.585044 0.284233 -1.453201
O 0.259464 0.088654 3.376089
O -3.663058 -0.085217 -1.802473
N 2.747020 -0.372453 0.697572
N 0.095773 -0.269714 1.041408
N -1.263287 -0.042645 0.939764
C 3.090944 1.044852 0.376991
C 3.881382 -1.274023 0.348646
C 3.461565 1.170301 -1.109140
C 4.233893 -1.110062 -1.139237
C 2.268247 -0.528617 2.093979
C 0.769497 -0.184387 2.260071
C -1.788222 -0.157570 -0.267406
C -3.200920 0.063637 -0.468656
C -4.276008 0.401825 0.354177
C -5.447274 0.468687 -0.482915
C -5.042590 0.170731 -1.777235
H 3.946605 1.393212 1.002818
H 2.219583 1.687965 0.602653
H 3.581844 -2.320466 0.545865
H 4.783008 -1.046956 0.965816
H 2.579553 0.921095 -1.739517
H 3.805191 2.189944 -1.346805
H 5.122745 -1.705546 -1.403828
H 3.371816 -1.430023 -1.764586
H 2.394418 -1.584398 2.401680
H 2.830869 0.091039 2.826050
H 0.716628 -0.492560 0.234266
H -1.206091 -0.423021 -1.170972
H -4.209665 0.575859 1.425640
H -6.461276 0.707329 -0.168111
H -5.552801 0.097096 -2.733502


