%chk=000228412.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228412

0 1
O 2.855179 -2.517251 -0.596635
O 3.657815 1.928588 0.354926
N -3.768743 -0.813036 -0.373881
N -1.735004 2.948060 0.459121
C -1.116188 0.443991 -0.055062
C -1.715354 0.082288 -1.439669
C -1.766165 -0.439899 1.041844
C -3.250577 0.121582 -1.427385
C -3.299992 -0.386269 0.986278
C 0.399798 0.215240 -0.072128
C -1.446273 1.852419 0.234518
C -5.261223 -0.859984 -0.414319
C 1.292438 1.263192 0.166574
C 0.871483 -1.079071 -0.334710
C 2.257349 -1.305615 -0.354003
C 2.674804 0.996965 0.138901
C 3.185999 -0.281521 -0.119546
C 2.005090 -3.662020 -0.855083
C 3.260810 3.294945 0.634676
H -1.380506 -0.936917 -1.724807
H -1.323148 0.764907 -2.216707
H -1.410318 -0.131470 2.042753
H -1.434380 -1.490348 0.905078
H -3.608584 1.166406 -1.298140
H -3.632320 -0.228513 -2.411850
H -3.717160 -1.100083 1.730535
H -3.661237 0.625023 1.274909
H -5.581813 -1.227809 -1.402513
H -5.763275 0.099875 -0.222642
H -5.617259 -1.592039 0.328604
H 0.941220 2.268426 0.370786
H 0.173082 -1.887771 -0.519071
H 4.255383 -0.471497 -0.137589
H 1.412772 -3.499012 -1.759873
H 1.376243 -3.872504 0.014571
H 2.745704 -4.458496 -1.007480
H 4.234185 3.787607 0.758417
H 2.677145 3.339589 1.558831
H 2.713521 3.713320 -0.215129


%chk=000228412-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228412

0 1
O 2.929245 -2.578974 -0.608722
O 3.701474 1.996637 0.369665
N -3.827132 -0.761552 -0.364358
N -1.682568 2.970697 0.463521
C -1.097493 0.411361 -0.062448
C -1.737404 0.046880 -1.450388
C -1.787233 -0.476666 1.034939
C -3.275010 0.123309 -1.418511
C -3.322646 -0.382085 0.977532
C 0.436172 0.190165 -0.077796
C -1.411959 1.832085 0.229864
C -5.301972 -0.823941 -0.406974
C 1.332785 1.254701 0.165033
C 0.931430 -1.111508 -0.342235
C 2.331349 -1.332570 -0.359692
C 2.731234 1.010329 0.141923
C 3.236806 -0.278219 -0.119298
C 2.048165 -3.719349 -0.864465
C 3.236930 3.358994 0.649276
H -1.436816 -0.985703 -1.700277
H -1.336533 0.717122 -2.232310
H -1.422719 -0.180945 2.035485
H -1.486449 -1.524448 0.859546
H -3.597503 1.187218 -1.274349
H -3.673386 -0.207675 -2.395903
H -3.755451 -1.076423 1.721886
H -3.647313 0.652134 1.263404
H -5.630637 -1.175924 -1.401265
H -5.792076 0.162541 -0.209497
H -5.665960 -1.543562 0.348121
H 0.942719 2.255052 0.368325
H 0.239351 -1.936582 -0.531266
H 4.313947 -0.459045 -0.135060
H 1.429571 -3.558595 -1.769170
H 1.390928 -3.926096 0.002896
H 2.723509 -4.572194 -1.026621
H 4.153987 3.948879 0.792624
H 2.621974 3.395086 1.569087
H 2.657184 3.770164 -0.199423


