%chk=000245098.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245098

0 1
O -1.733449 0.521236 2.490945
O -5.582754 -0.861396 -1.394259
O -5.733204 1.289122 -0.780329
N -0.760222 0.418336 0.422550
C 0.598578 0.167571 0.947517
C 1.159043 -1.158969 0.439048
C 1.602423 1.180868 0.402988
C 2.365606 -0.935928 -0.290239
C 2.639764 0.510025 -0.312294
C 0.663978 -2.436354 0.621146
C 1.609560 2.555851 0.542439
C 3.066650 -2.001820 -0.832986
C 3.679326 1.228623 -0.882436
C 1.378829 -3.515622 0.064485
C 2.666781 3.281431 -0.041983
C 2.557201 -3.301319 -0.648520
C 3.681625 2.629357 -0.740327
C -1.845206 0.578665 1.279883
C -3.149842 0.857264 0.592609
C -3.789147 -0.049592 -0.145813
C -5.099081 0.260789 -0.760930
H 0.578410 0.186931 2.074128
H -0.855288 0.463145 -0.588207
H -0.251527 -2.611629 1.183076
H 0.823455 3.071390 1.090896
H 3.988833 -1.844850 -1.386961
H 4.477123 0.728466 -1.425872
H 1.001926 -4.528700 0.199265
H 2.686772 4.365848 0.059103
H 3.097551 -4.148534 -1.069712
H 4.492323 3.206998 -1.183403
H -3.553608 1.860268 0.790720
H -3.413440 -1.061730 -0.334666
H -6.469889 -0.706543 -1.820964


%chk=000245098-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245098

0 1
O -1.652217 0.558727 2.655734
O -5.359445 -0.404139 -1.896410
O -5.986928 0.988213 -0.135289
N -0.820412 0.365891 0.480577
C 0.574752 0.150051 0.900485
C 1.170346 -1.188492 0.446394
C 1.566713 1.164339 0.321286
C 2.392282 -0.969593 -0.255521
C 2.637805 0.486892 -0.332756
C 0.678126 -2.486142 0.656736
C 1.529881 2.566108 0.387857
C 3.136857 -2.063764 -0.745665
C 3.691414 1.220528 -0.918714
C 1.423335 -3.585153 0.157452
C 2.585184 3.303213 -0.208167
C 2.642000 -3.372945 -0.534358
C 3.655915 2.633994 -0.851869
C -1.843931 0.542767 1.396968
C -3.223732 0.713150 0.841653
C -3.698458 0.115843 -0.287571
C -5.107687 0.304023 -0.709511
H 0.547336 0.211073 2.008333
H -1.014181 0.433192 -0.520732
H -0.260024 -2.649761 1.198749
H 0.706152 3.082884 0.892938
H 4.080441 -1.910710 -1.281112
H 4.523999 0.712527 -1.417922
H 1.057584 -4.606375 0.310819
H 2.576218 4.397930 -0.167399
H 3.206325 -4.233936 -0.909723
H 4.464872 3.219490 -1.302916
H -3.903057 1.309201 1.463752
H -3.091033 -0.544409 -0.916416
H -6.307332 -0.265423 -2.166786


