%chk=000259733.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259733

0 1
O 3.839697 -1.857575 -0.145893
O -0.136426 1.102971 -0.362624
O 0.257512 -1.958044 -0.012474
O 1.697612 -2.940967 -1.458069
O -2.513253 0.102413 -2.180282
O 0.073834 3.304943 0.089304
N -4.148472 0.285889 0.472247
C 2.364693 -0.267745 0.835060
C 2.584493 -1.776820 0.531193
C 2.479502 0.539235 -0.478453
C -1.591230 1.231367 -0.288843
C -2.010515 1.286692 1.178299
C 3.363052 0.226986 1.879870
C -3.538112 1.371917 1.303982
C 2.587087 -2.688817 1.752338
C 2.063602 1.968715 -0.307876
C 1.502396 -2.300542 -0.451801
C -1.980718 -1.358917 -0.387357
C -2.096728 -0.018429 -1.052844
C -4.010992 -1.059862 1.111264
C -0.874536 -2.226443 -0.911767
C -2.819506 -1.794453 0.560327
C 0.611758 2.248529 -0.167158
C 2.901089 3.022787 -0.287961
C -5.562392 0.592238 0.118465
C 4.377769 2.942331 -0.417539
H 1.318135 -0.158717 1.227364
H 1.847098 0.076063 -1.268871
H 3.523464 0.469629 -0.858679
H -1.891653 2.153499 -0.841055
H -1.544752 2.175623 1.655387
H -1.610701 0.405498 1.718057
H 3.317546 1.318114 1.982805
H 3.169067 -0.202916 2.867470
H 4.391950 -0.033702 1.595760
H -3.835499 1.332970 2.372978
H -3.886473 2.356093 0.915950
H 3.461088 -2.479383 2.385537
H 1.686763 -2.548855 2.363707
H 2.644652 -3.749436 1.479774
H -4.916625 -1.681928 0.910329
H -3.923986 -1.003197 2.221585
H -1.087034 -3.307719 -0.844142
H -0.574229 -1.976803 -1.948766
H -2.686341 -2.788295 1.001619
H 3.936997 -2.715933 -0.622875
H 2.503144 4.041152 -0.172922
H -5.593044 1.545396 -0.437943
H -6.250352 0.663654 0.972541
H -5.934589 -0.181005 -0.575752
H 4.725439 3.487069 -1.309228
H 4.749262 1.907619 -0.504330
H 4.878260 3.393910 0.452195


%chk=000259733-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259733

0 1
O 3.862858 -2.085350 -0.311050
O -0.161208 1.031175 -0.103679
O 0.230786 -2.095302 0.192837
O 1.578165 -2.625136 -1.637605
O -2.543532 0.011786 -1.970949
O 0.043171 3.345569 0.101269
N -4.124524 0.288147 0.535016
C 2.521472 -0.330602 0.826258
C 2.631457 -1.853824 0.459052
C 2.514972 0.533014 -0.475740
C -1.641912 1.198865 -0.036312
C -2.119346 1.391470 1.410374
C 3.663813 0.101199 1.769440
C -3.658858 1.446139 1.342744
C 2.666551 -2.770372 1.701342
C 2.052755 1.961756 -0.255216
C 1.440547 -2.238689 -0.447336
C -2.104326 -1.429560 -0.092831
C -2.247654 -0.048582 -0.730603
C -4.170045 -1.011357 1.244257
C -1.018851 -2.331390 -0.625309
C -3.020097 -1.889413 0.797918
C 0.589802 2.224338 -0.065065
C 2.857406 3.071205 -0.243379
C -5.204369 0.520847 -0.440691
C 4.349017 3.126706 -0.431231
H 1.547058 -0.199943 1.333751
H 1.845855 0.068465 -1.223080
H 3.532206 0.513679 -0.903138
H -1.907218 2.082417 -0.648418
H -1.708088 2.324735 1.831342
H -1.776856 0.545769 2.035761
H 3.641287 1.195869 1.917339
H 3.577509 -0.368544 2.765059
H 4.642436 -0.176573 1.337829
H -4.113567 1.454546 2.355965
H -3.974573 2.372476 0.828957
H 3.617257 -2.613669 2.235443
H 1.822855 -2.553820 2.378402
H 2.621571 -3.831072 1.399036
H -5.136267 -1.521113 1.049771
H -4.124597 -0.849199 2.342625
H -1.269020 -3.399323 -0.502800
H -0.788639 -2.124021 -1.684354
H -2.965739 -2.913084 1.195201
H 3.590323 -2.350648 -1.233766
H 2.352546 4.036544 -0.086388
H -4.985798 1.433423 -1.019355
H -6.203708 0.621064 0.035479
H -5.224899 -0.315935 -1.160904
H 4.601367 3.766015 -1.300270
H 4.808051 2.137065 -0.581659
H 4.829403 3.599036 0.448565


