%chk=000231892.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231892

0 1
O -2.099403 -0.025577 -1.683197
O -4.547815 0.966730 0.010470
O 4.576661 -0.974598 -0.081655
O 4.470260 1.182420 -0.209942
O -4.727520 -1.249338 -0.348177
N 3.964337 0.080696 -0.072709
C -0.255131 -0.093473 0.503501
C -1.741089 -0.152544 0.720669
C 0.496951 -1.279210 0.479147
C 0.376789 1.149144 0.330468
C 2.499639 0.020049 0.123658
C 1.877012 -1.227097 0.288292
C 1.755906 1.210692 0.138300
C -2.519586 -0.122359 -0.568486
C -4.045166 -0.261872 -0.313478
H -2.076164 0.698535 1.365245
H -2.018907 -1.061713 1.306516
H 0.007333 -2.246126 0.599974
H -0.208497 2.069503 0.333654
H 2.478272 -2.143562 0.264178
H 2.263988 2.172040 -0.001853
H -5.537769 0.962461 0.147125


%chk=000231892-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231892

0 1
O -2.126734 0.615672 -1.714591
O -4.498001 -0.282991 0.810973
O 4.666941 -1.061490 0.335044
O 4.558547 1.084097 -0.431952
O -4.957100 0.297545 -1.401607
N 4.009984 0.002012 0.009962
C -0.265962 -0.061907 0.438480
C -1.770172 -0.090417 0.626473
C 0.510616 -1.199363 0.778880
C 0.390979 1.096693 -0.054558
C 2.532561 -0.021238 0.154655
C 1.912652 -1.190987 0.641767
C 1.790337 1.126743 -0.198310
C -2.593788 0.239032 -0.619928
C -4.139036 0.098207 -0.488370
H -2.088293 0.630976 1.409476
H -2.112567 -1.069438 1.009713
H 0.014703 -2.101158 1.155321
H -0.194882 1.976516 -0.337287
H 2.525245 -2.058360 0.900331
H 2.312356 2.009147 -0.576950
H -5.488287 -0.364489 0.884179


