%chk=000235537.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235537

0 1
O -1.710470 -1.782696 1.594026
O -2.296773 -2.926478 -0.232361
O -2.482045 2.331345 -0.852586
N -2.441226 0.548820 0.656099
N -2.601255 2.817871 1.387659
C -2.086905 -0.450992 -0.394789
C -0.693343 -0.205568 -1.016686
C 0.444848 -0.146137 0.006379
C 1.811778 -0.117210 -0.690879
C 2.956175 -0.028813 0.327736
C 4.323361 -0.003921 -0.368483
C -3.173886 -0.465566 -1.472351
C -2.073809 -1.852428 0.263286
C 5.470384 0.085157 0.648033
C -2.504038 1.920065 0.296973
C 6.833532 0.109683 -0.039801
H -0.490366 -0.986881 -1.776471
H -0.734277 0.752909 -1.585429
H 0.333898 0.754156 0.642915
H 0.393197 -1.011400 0.697559
H 1.861345 0.742959 -1.387203
H 1.936415 -1.020929 -1.318474
H 2.905984 -0.885539 1.027068
H 2.835930 0.878066 0.951593
H 4.446370 -0.909176 -0.993611
H 4.375803 0.852541 -1.068071
H -4.177032 -0.585307 -1.043560
H -3.181749 0.486689 -2.031781
H -3.022507 -1.279608 -2.192636
H -2.108795 0.310504 1.599252
H 5.350682 0.992568 1.271864
H 5.420690 -0.771810 1.347927
H 6.930778 0.969343 -0.712669
H 7.645820 0.173299 0.692778
H 7.000736 -0.793678 -0.637367
H -1.695946 -2.672898 2.036026
H -2.968004 2.510804 2.275039
H -2.859303 3.769455 1.147596


%chk=000235537-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000235537

0 1
O -2.463491 -1.669519 1.769887
O -2.046425 -2.920467 -0.135998
O -2.173951 2.405762 -0.929436
N -2.383635 0.638536 0.611785
N -2.652142 2.864894 1.302627
C -2.124554 -0.456575 -0.349177
C -0.698666 -0.349711 -0.994099
C 0.468656 -0.357102 0.013940
C 1.833292 -0.134770 -0.676553
C 3.023627 -0.147085 0.308720
C 4.387900 0.086012 -0.378694
C -3.206155 -0.488860 -1.471042
C -2.198521 -1.800663 0.390413
C 5.580267 0.069535 0.605029
C -2.389075 1.981148 0.250635
C 6.939425 0.302647 -0.089747
H -0.591873 -1.193007 -1.702312
H -0.690892 0.590318 -1.574412
H 0.308783 0.436225 0.771153
H 0.495894 -1.322558 0.562052
H 1.812792 0.834240 -1.216823
H 1.987870 -0.918390 -1.447463
H 3.045992 -1.118867 0.845620
H 2.866034 0.632597 1.083436
H 4.545138 -0.690946 -1.156073
H 4.368171 1.059026 -0.912883
H -4.217030 -0.584520 -1.036727
H -3.149816 0.455750 -2.034944
H -3.023916 -1.340746 -2.146939
H -2.544078 0.359146 1.581033
H 5.422234 0.846035 1.381490
H 5.598442 -0.903098 1.138389
H 6.958010 1.281500 -0.605285
H 7.774415 0.286542 0.634938
H 7.135055 -0.478484 -0.848580
H -2.496979 -2.572876 2.184892
H -2.856350 2.573307 2.255887
H -2.668448 3.854221 1.069862


