%chk=000296502.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296502

0 1
O 2.289336 1.802772 -2.237568
O 4.464271 -1.461295 1.645992
N -4.420950 -0.835062 -1.186665
N -3.498649 -1.263080 -1.938261
C -2.783835 -0.047777 0.470465
C -1.753531 -0.547220 -0.402643
C 2.034094 0.090008 -0.532426
C -4.130950 -0.211881 0.043463
C -0.338160 -0.442014 -0.029802
C 0.612352 -0.025007 -0.878986
C 2.837758 1.049379 -1.198669
C 2.643238 -0.733439 0.415120
C -2.538935 0.602677 1.717771
C 4.020270 -0.580529 0.683604
C 4.198927 1.197722 -0.924638
C -5.210567 0.255607 0.854127
C -2.148414 -1.142789 -1.587964
C 4.807099 0.373192 0.026507
C -3.589882 1.046829 2.483212
C -4.937350 0.871162 2.050191
C 1.671491 3.039824 -1.798461
C 5.871030 -1.436314 1.987971
H -0.108963 -0.729391 1.000768
H 0.375773 0.284766 -1.906881
H 2.084841 -1.505008 0.943237
H -1.509424 0.742907 2.047015
H 4.777785 1.945533 -1.466310
H -6.231506 0.108803 0.495151
H -1.442391 -1.558706 -2.311796
H 5.866530 0.479827 0.235328
H -3.410679 1.543413 3.437322
H -5.743754 1.235792 2.686678
H 2.418763 3.689551 -1.335947
H 0.845479 2.829324 -1.113743
H 1.307482 3.463213 -2.742155
H 5.930040 -2.230911 2.743945
H 6.141432 -0.467313 2.416570
H 6.480348 -1.683164 1.113779


%chk=000296502-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296502

0 1
O 2.252065 1.736958 -2.442918
O 4.184275 -0.940867 2.119583
N -4.758980 0.369118 -1.029064
N -3.777595 0.596982 -1.934481
C -3.023135 -0.074475 0.733141
C -1.991177 0.181829 -0.250336
C 1.891215 0.484812 -0.418459
C -4.394661 0.025848 0.279668
C -0.565377 0.094144 0.077513
C 0.455674 0.578651 -0.703433
C 2.821863 1.094023 -1.331282
C 2.419163 -0.181031 0.715348
C -2.787310 -0.404434 2.108049
C 3.808126 -0.247421 0.955232
C 4.210041 1.027085 -1.091259
C -5.473975 -0.219147 1.188840
C -2.452181 0.492237 -1.551525
C 4.711677 0.359751 0.049645
C -3.855945 -0.638803 2.977010
C -5.209856 -0.549659 2.517239
C 3.154191 2.365417 -3.409078
C 5.615228 -1.040782 2.410410
H -0.315209 -0.396248 1.026068
H 0.215607 1.110015 -1.631015
H 1.757421 -0.669290 1.436632
H -1.764311 -0.466592 2.491567
H 4.918507 1.490440 -1.783444
H -6.491575 -0.132054 0.795593
H -1.754269 0.660462 -2.376427
H 5.792341 0.322172 0.213785
H -3.658757 -0.890356 4.024980
H -6.032689 -0.737304 3.215156
H 3.834717 1.621244 -3.866730
H 3.746587 3.174154 -2.938718
H 2.496024 2.789684 -4.181194
H 5.678871 -1.614621 3.346505
H 6.069273 -0.040744 2.556058
H 6.154535 -1.579797 1.606641


