%chk=000220489.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220489

0 1
O -0.824357 -1.751855 3.360539
N -2.246627 -0.112186 0.040401
N -1.950806 4.503602 1.485614
N -5.431887 -1.403515 -3.378538
C -1.736907 -1.317972 0.774459
C -2.320241 1.091823 0.925620
C -3.553872 -0.395315 -0.630666
C -0.290339 -1.123210 1.146636
C 0.659238 -0.717417 0.206370
C 0.149689 -1.361529 2.467071
C 2.007880 -0.551016 0.566786
C -1.900785 2.311176 0.076074
C -3.243911 -0.979926 -2.026044
C 2.415242 -0.799754 1.885889
C 1.488664 -1.209582 2.846854
C 2.992927 -0.112879 -0.445051
C 3.740153 1.058042 -0.239762
C 3.184155 -0.865184 -1.615055
C -1.929615 3.530926 0.861727
C -4.462986 -1.215184 -2.777525
C 4.668537 1.470630 -1.198852
C 4.116114 -0.447868 -2.568636
C 4.858645 0.719503 -2.363308
H -1.817094 -2.201352 0.098199
H -2.341360 -1.561374 1.680897
H -3.324860 1.254927 1.369916
H -1.617101 0.983905 1.783729
H -4.204216 -1.091924 -0.058334
H -4.135443 0.546216 -0.748977
H 0.339647 -0.513132 -0.818663
H -0.875676 2.139939 -0.336623
H -2.558925 2.412093 -0.817713
H -2.571840 -0.283021 -2.583851
H -2.661395 -1.926415 -1.932348
H 3.463152 -0.676920 2.163069
H 1.804803 -1.403710 3.867252
H 3.590125 1.647051 0.663483
H 2.611304 -1.777017 -1.773782
H -0.454860 -1.905038 4.264950
H 5.244926 2.380684 -1.038619
H 4.265017 -1.034577 -3.473852
H 5.583185 1.042759 -3.108136


%chk=000220489-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000220489

0 1
O -0.782099 -2.061159 3.485878
N -2.249665 -0.060352 0.091556
N -2.133923 4.830008 0.738525
N -5.311892 -1.997741 -3.256184
C -1.811774 -1.126953 1.032310
C -2.281542 1.282566 0.717402
C -3.476916 -0.411501 -0.656282
C -0.316867 -1.084434 1.331009
C 0.616723 -0.598092 0.392387
C 0.172203 -1.563878 2.574558
C 2.014095 -0.567155 0.649384
C -1.966614 2.392293 -0.327137
C -3.131497 -1.284023 -1.899157
C 2.465164 -1.047370 1.907978
C 1.555935 -1.541428 2.863363
C 2.972873 -0.049441 -0.368276
C 4.165389 0.622533 0.020528
C 2.721116 -0.211095 -1.759474
C -2.057270 3.743586 0.250744
C -4.328783 -1.686815 -2.655228
C 5.072371 1.111693 -0.943502
C 3.624757 0.281123 -2.724971
C 4.807104 0.944908 -2.322615
H -2.056404 -2.106233 0.575204
H -2.375754 -1.094575 1.991189
H -3.257658 1.498981 1.209815
H -1.506216 1.314633 1.501666
H -4.220497 -0.948888 -0.023765
H -3.969024 0.513742 -1.004484
H 0.218030 -0.204447 -0.548873
H -0.948874 2.229871 -0.726603
H -2.665922 2.327975 -1.182321
H -2.450823 -0.715107 -2.558561
H -2.586570 -2.193594 -1.583462
H 3.536838 -1.066333 2.132125
H 1.925357 -1.921817 3.824677
H 4.369321 0.791681 1.084175
H 1.827140 -0.754554 -2.086401
H -0.352320 -2.330504 4.335057
H 5.979840 1.633288 -0.619095
H 3.413093 0.136718 -3.790471
H 5.509855 1.326294 -3.071466


