%chk=000250358.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250358

0 1
O 3.598499 -2.393426 0.502191
O -2.553682 1.816938 -0.742331
O -7.508933 -0.734862 -0.935942
O -7.463737 0.811452 0.688453
N -2.383259 -0.124393 0.510799
C 1.770595 -0.905141 0.363102
C -0.973113 -0.354217 0.433350
C 3.221155 -1.251058 0.334193
C 4.197488 -0.141377 0.092086
C 1.252301 0.196304 -0.332437
C 0.899506 -1.742287 1.082529
C -0.112580 0.478413 -0.302389
C -0.464611 -1.472831 1.130703
C 4.083946 1.079907 0.770479
C 5.260609 -0.357001 -0.796019
C 5.025916 2.087713 0.548668
C 6.194777 0.657712 -1.022435
C 6.077500 1.878906 -0.350815
C -3.080510 0.948260 -0.083319
C -4.552618 0.923754 0.209321
C -5.397383 0.093288 -0.400284
C -6.851000 0.148997 -0.114498
H 1.918294 0.840817 -0.913003
H 1.308226 -2.614526 1.603588
H -0.505016 1.341957 -0.850924
H -1.122556 -2.126775 1.697963
H 3.267340 1.240706 1.475113
H 5.357037 -1.320489 -1.300403
H -2.916183 -0.808506 1.056737
H 4.941875 3.035887 1.077423
H 7.017405 0.493350 -1.716847
H 6.808351 2.667996 -0.525036
H -4.878717 1.685413 0.932616
H -5.096263 -0.655044 -1.143248
H -8.495961 -0.731138 -0.790781


%chk=000250358-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000250358

0 1
O 3.469403 -2.408773 0.067294
O -2.689706 2.204236 -0.567328
O -7.455206 -1.326428 -0.111542
O -7.623135 0.964920 0.288776
N -2.480440 0.020558 0.301682
C 1.706300 -0.781722 0.146067
C -1.080459 -0.200201 0.223052
C 3.153090 -1.175243 0.074390
C 4.230351 -0.128235 0.010663
C 1.196301 0.426027 -0.401057
C 0.788961 -1.707101 0.716228
C -0.180171 0.723539 -0.374217
C -0.581178 -1.419566 0.765681
C 4.100117 1.147297 0.624672
C 5.456162 -0.470510 -0.622363
C 5.172939 2.065021 0.592891
C 6.519099 0.452535 -0.668309
C 6.379717 1.724722 -0.061086
C -3.208124 1.145801 -0.096341
C -4.692075 1.045742 0.069936
C -5.435874 -0.089587 -0.058749
C -6.914188 -0.042977 0.062626
H 1.876688 1.132112 -0.887360
H 1.179809 -2.651161 1.108747
H -0.564915 1.650076 -0.802607
H -1.273759 -2.138982 1.221577
H 3.178892 1.407686 1.156160
H 5.551724 -1.468059 -1.063830
H -3.018035 -0.726589 0.749041
H 5.069925 3.040229 1.081213
H 7.455516 0.184485 -1.169530
H 7.208308 2.441189 -0.090753
H -5.199784 2.006186 0.223092
H -5.005257 -1.070661 -0.289476
H -8.446298 -1.281868 -0.030639


