%chk=000266284.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266284

0 1
O 3.540753 -3.444111 -1.115640
N 2.483283 -0.951722 0.437234
N 2.147529 1.275667 -0.011467
N -3.163907 1.644865 -0.198696
N -2.851298 -0.591399 0.228178
C 3.758175 -0.367343 0.321805
C 3.527889 1.024717 0.051050
C 1.533369 0.090945 0.208281
C 2.215212 -2.381849 0.637312
C 5.059871 -0.889154 0.429554
C 6.124367 -0.014870 0.267539
C 5.905658 1.382467 -0.001894
C 4.623983 1.897075 -0.108047
C 0.096889 -0.143902 0.233520
C 2.206260 -3.152887 -0.697032
C -4.442744 1.070199 -0.112357
C -4.230228 -0.326537 0.153959
C -2.228887 0.589833 0.017126
C -0.793796 0.834326 -0.005250
C 7.521317 -0.537335 0.374697
C -6.811444 0.744057 -0.092851
C 7.079279 2.295065 -0.169172
C -6.611853 -0.655896 0.173647
C -5.735104 1.608437 -0.236244
C -5.337285 -1.186409 0.295840
C -8.201319 1.281779 -0.218356
C -7.797647 -1.556188 0.321831
H 3.000060 -2.812670 1.306539
H 1.241976 -2.510161 1.165816
H 5.214829 -1.944361 0.640497
H 4.437245 2.950854 -0.309174
H -0.232196 -1.166633 0.458591
H 1.759170 -4.159162 -0.572892
H 1.672345 -2.605272 -1.494721
H -0.469703 1.858980 -0.227740
H 8.086503 -0.360640 -0.551837
H 8.068880 -0.044009 1.191024
H 7.557404 -1.616932 0.571481
H -2.958626 2.609797 -0.373010
H 7.716082 1.978529 -1.007203
H 6.779922 3.332626 -0.368992
H 7.704735 2.311122 0.734612
H -5.876034 2.665458 -0.437267
H -5.166725 -2.242685 0.497343
H -8.776958 1.116594 0.704024
H -8.223154 2.360229 -0.421341
H -8.746323 0.789512 -1.036932
H -7.512328 -2.597539 0.522396
H -8.441781 -1.235307 1.152627
H -8.411143 -1.562556 -0.590129
H 4.006398 -2.616100 -1.373880


%chk=000266284-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000266284

0 1
O 3.458684 -3.332222 -1.296465
N 2.505900 -0.969173 0.413677
N 2.152490 1.263650 -0.024467
N -3.153164 1.627543 -0.181636
N -2.845306 -0.603570 0.224927
C 3.776356 -0.378558 0.305267
C 3.529948 1.012063 0.041535
C 1.554385 0.062791 0.197080
C 2.240800 -2.392400 0.675169
C 5.083238 -0.897603 0.418560
C 6.169648 -0.006079 0.268326
C 5.940087 1.395784 0.000812
C 4.625910 1.894009 -0.112027
C 0.127244 -0.173691 0.214571
C 2.163482 -3.235203 -0.616429
C -4.436226 1.076504 -0.109962
C -4.219344 -0.322625 0.145443
C -2.222299 0.586781 0.024971
C -0.795573 0.823627 0.013253
C 7.588825 -0.533719 0.384884
C -6.835581 0.751893 -0.100609
C 7.120513 2.338390 -0.160845
C -6.637084 -0.656444 0.156072
C -5.729250 1.621023 -0.234243
C -5.334615 -1.183421 0.276674
C -8.242671 1.308653 -0.228313
C -7.838034 -1.576189 0.297348
H 3.055107 -2.783330 1.310769
H 1.299331 -2.489401 1.244230
H 5.267827 -1.959732 0.610207
H 4.443768 2.954116 -0.315146
H -0.248214 -1.187988 0.390647
H 1.901538 -4.275150 -0.358604
H 1.381730 -2.827055 -1.290420
H -0.431955 1.843139 -0.166308
H 8.168453 -0.357633 -0.542033
H 8.143453 -0.035295 1.203424
H 7.597425 -1.618529 0.584602
H -2.918023 2.603872 -0.350631
H 7.776287 2.035493 -1.000085
H 6.780494 3.369253 -0.356318
H 7.755487 2.359666 0.746031
H -5.891053 2.686958 -0.428860
H -5.177308 -2.249186 0.470541
H -8.832248 1.144276 0.694448
H -8.227961 2.393575 -0.428186
H -8.801466 0.822030 -1.051017
H -7.520875 -2.615210 0.488034
H -8.496069 -1.266998 1.132545
H -8.464078 -1.577997 -0.616039
H 3.738888 -2.431185 -1.601005


