%chk=000228526.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228526

0 1
O -2.938257 0.905185 -0.332012
O -0.449817 1.743683 -0.496818
O -3.389203 -1.239300 0.241664
N 1.217142 0.240114 -0.043501
N 0.710427 -2.045439 0.565495
C 1.622721 -1.055264 0.319321
C 2.179057 1.235515 -0.290256
C 3.523235 0.970835 -0.184172
C -0.256133 0.599724 -0.178853
C -1.114091 -0.508537 0.102158
C 3.031490 -1.328647 0.429521
C 3.950560 -0.349089 0.186089
C -0.607561 -1.767006 0.456505
C 4.542391 2.025650 -0.445433
C -2.571846 -0.365445 0.028490
C -4.370492 1.197625 -0.424579
C -4.954918 1.364571 0.962435
H 1.777164 2.223612 -0.569611
H 3.316035 -2.347513 0.714056
H 5.021874 -0.550177 0.267982
H -1.301907 -2.603758 0.666144
H 5.217844 1.737477 -1.265762
H 5.166610 2.209687 0.442686
H 4.098233 2.991840 -0.725923
H -4.342698 2.138822 -1.004477
H -4.858248 0.390552 -0.998888
H -5.983172 1.740720 0.923143
H -4.971985 0.405167 1.502058
H -4.362154 2.064695 1.565438


%chk=000228526-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228526

0 1
O -3.003228 0.931297 -0.337443
O -0.384381 1.846049 -0.480213
O -3.344184 -1.303841 0.235253
N 1.279976 0.220964 -0.042245
N 0.734882 -2.080661 0.513542
C 1.651937 -1.095612 0.291803
C 2.230398 1.210320 -0.263842
C 3.593714 0.955854 -0.168483
C -0.175301 0.643868 -0.180874
C -1.079681 -0.457217 0.069319
C 3.052079 -1.374657 0.393858
C 3.999298 -0.381629 0.171113
C -0.574778 -1.739465 0.398279
C 4.613913 2.047076 -0.412829
C -2.561564 -0.339760 0.006424
C -4.486073 1.119525 -0.398146
C -5.048693 1.445628 0.988614
H 1.801649 2.184516 -0.514407
H 3.319897 -2.401229 0.653468
H 5.066595 -0.615225 0.253785
H -1.304859 -2.535856 0.578218
H 5.290830 1.778488 -1.244909
H 5.243967 2.208639 0.481439
H 4.130171 3.004977 -0.664535
H -4.604233 1.960372 -1.100001
H -4.943925 0.203961 -0.812287
H -6.125953 1.682493 0.905467
H -4.935231 0.586059 1.669614
H -4.534921 2.320364 1.422918


