%chk=000245518.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245518

0 1
O -3.966414 0.887753 -0.282579
O -3.478892 -1.418641 0.884767
N -0.913839 0.238316 -0.332929
N 1.140918 1.110754 0.511478
N 1.061328 -1.071841 -0.601000
N 3.227567 -0.115626 0.068162
N 3.233223 1.945240 1.224085
N 3.079937 -2.260192 -0.913458
C -1.640710 1.287933 0.439012
C -1.711407 -0.943098 -0.753217
C 0.452700 0.077154 -0.110646
C -2.865402 1.805397 -0.325857
C -2.177281 -1.820811 0.417669
C 2.516699 0.960899 0.575667
C 2.440755 -1.114981 -0.482286
H -0.945103 2.141851 0.641828
H -1.951365 0.888446 1.433210
H -1.108883 -1.549354 -1.473514
H -2.600242 -0.564717 -1.320459
H -2.676405 1.937055 -1.408646
H -3.213420 2.763425 0.106233
H -1.545377 -1.714070 1.320002
H -2.219255 -2.887236 0.133503
H -3.988563 0.418567 0.597362
H -4.145746 -1.539633 0.170496
H 2.776268 2.803586 1.487672
H 4.240843 1.929296 1.192118
H 4.087380 -2.276362 -0.959578
H 2.568584 -2.941210 -1.452196


%chk=000245518-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245518

0 1
O -3.795087 1.091802 -0.793362
O -3.648190 -1.144944 0.802386
N -0.921422 0.041416 -0.033542
N 1.113464 1.107053 0.532623
N 1.098902 -1.071874 -0.558488
N 3.226647 -0.003180 -0.001009
N 3.174062 2.088482 1.044091
N 3.147090 -2.092878 -1.047076
C -1.663491 1.171807 0.573964
C -1.661266 -1.082731 -0.642724
C 0.462334 0.026084 -0.019028
C -2.640654 1.893969 -0.375110
C -2.467867 -1.927604 0.351081
C 2.479945 1.030824 0.508454
C 2.466281 -1.021874 -0.519564
H -0.900922 1.886228 0.924445
H -2.226792 0.801968 1.453020
H -0.904354 -1.735487 -1.107812
H -2.340932 -0.697895 -1.424216
H -2.118643 2.210081 -1.296931
H -2.995460 2.807573 0.151543
H -1.843426 -2.204361 1.223164
H -2.811476 -2.847294 -0.165611
H -3.945025 0.352223 -0.132558
H -4.241962 -1.697314 1.365819
H 2.659261 2.877169 1.425245
H 4.189923 2.065270 1.035790
H 4.163165 -2.082424 -1.036531
H 2.623791 -2.864187 -1.451161


