%chk=000229451.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229451

0 1
O -2.161952 1.159374 -1.666978
O -2.138373 1.745204 0.535618
O -1.152869 -0.646029 2.374638
O -0.659160 -3.620021 -1.126102
N -0.956019 -1.284175 -1.130587
N -0.918428 -2.387225 0.867584
C -0.956188 -0.205673 -0.094494
C 0.284840 0.693205 -0.126262
C 1.603381 -0.051727 0.091627
C -2.254543 0.627632 -0.336738
C -1.034190 -1.014105 1.239918
C 2.796480 0.910047 -0.000521
C 4.124678 0.173106 0.215905
C -0.799848 -2.568194 -0.553100
C 5.319765 1.132315 0.122506
C -3.251727 0.816391 -2.545636
C -3.270699 2.640756 0.529915
C 6.644918 0.404461 0.336535
H 0.153459 1.485892 0.649183
H 0.297431 1.246985 -1.090659
H 1.720868 -0.862216 -0.653230
H 1.603697 -0.547193 1.083553
H -3.187336 0.060752 -0.168788
H -0.599628 -1.066953 -2.057424
H 2.801596 1.414150 -0.986347
H 2.687799 1.717458 0.750270
H 4.123451 -0.327384 1.203639
H 4.235771 -0.636980 -0.530354
H -0.932426 -3.164512 1.522062
H 5.324394 1.633892 -0.865012
H 5.212777 1.941039 0.871977
H 7.492065 1.096149 0.268505
H 6.801061 -0.379930 -0.412780
H 6.689439 -0.071904 1.322663
H -2.973746 1.325602 -3.477952
H -4.197232 1.206802 -2.160487
H -3.293758 -0.267385 -2.694823
H -3.404929 3.065473 -0.469816
H -2.957051 3.412896 1.244733
H -4.167369 2.124726 0.881960


%chk=000229451-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229451

0 1
O -2.182665 1.081224 -1.772979
O -2.174677 1.791093 0.522605
O -1.055025 -0.555633 2.389123
O -0.956218 -3.636278 -1.180299
N -0.870527 -1.253858 -1.111867
N -1.059515 -2.340055 0.831427
C -0.909940 -0.173677 -0.107283
C 0.352062 0.729276 -0.106748
C 1.680136 -0.034730 0.076151
C -2.204732 0.665424 -0.358046
C -1.022602 -0.993372 1.217553
C 2.899214 0.914101 0.022635
C 4.246562 0.183993 0.219256
C -0.957631 -2.532166 -0.585485
C 5.465649 1.133387 0.171702
C -3.409919 0.766059 -2.521442
C -3.394171 2.608359 0.490419
C 6.809202 0.399710 0.372685
H 0.218218 1.463597 0.706967
H 0.361965 1.297685 -1.057136
H 1.785677 -0.812548 -0.706817
H 1.678455 -0.561344 1.052356
H -3.117382 0.043954 -0.185099
H -0.798975 -1.068381 -2.110217
H 2.908829 1.446229 -0.951897
H 2.788172 1.695826 0.802486
H 4.236774 -0.348959 1.193009
H 4.360635 -0.597439 -0.561097
H -1.117207 -3.125138 1.480419
H 5.475209 1.665296 -0.801813
H 5.348395 1.914185 0.950806
H 7.663974 1.099874 0.332673
H 6.963023 -0.367003 -0.410178
H 6.837857 -0.112984 1.352778
H -3.240565 1.143539 -3.542088
H -4.296856 1.269813 -2.089213
H -3.593797 -0.326309 -2.558727
H -3.490190 3.132465 -0.478714
H -3.282518 3.342282 1.302041
H -4.294496 1.985208 0.674759


