%chk=000211612.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211612

0 1
O -0.164304 1.312645 2.184951
N 0.024165 -0.139531 0.437054
N -2.670393 0.346913 -0.135743
C 1.261904 -0.775100 0.959740
C -1.889695 1.459034 0.477328
C 1.003139 -2.235142 1.394982
C 2.327884 -0.703896 -0.122243
C -0.620551 0.867464 1.141120
C -3.622485 0.820684 -1.188893
C -2.665369 2.274987 1.512277
C 0.206637 -2.306304 2.692813
C -4.420256 -0.381014 -1.722651
C 3.429728 0.144604 0.058440
C 2.224165 -1.462503 -1.297124
C 4.421377 0.226093 -0.923140
C 3.216845 -1.377108 -2.277355
C -5.349583 0.037037 -2.857705
C 4.317481 -0.534582 -2.091947
H 1.593384 -0.183906 1.864583
H -1.527498 2.143216 -0.338783
H 0.474744 -2.791097 0.597015
H 1.978564 -2.747134 1.522494
H -0.403229 -0.554343 -0.389917
H -3.181499 -0.162430 0.595237
H -3.026579 1.274370 -2.011783
H -4.315844 1.608911 -0.824433
H -3.096886 1.643692 2.298077
H -1.994897 2.979304 2.031587
H -3.472809 2.853038 1.054885
H 0.734096 -1.815184 3.520517
H 0.019412 -3.343885 2.989055
H -0.765274 -1.805996 2.596968
H -5.007252 -0.846140 -0.906839
H -3.719484 -1.165873 -2.074131
H 3.512662 0.747086 0.962942
H 1.371671 -2.121086 -1.450014
H -6.076218 0.791072 -2.533890
H -4.793591 0.457707 -3.703949
H -5.917606 -0.820772 -3.237316
H 5.275187 0.885718 -0.776891
H 3.132104 -1.968330 -3.187379
H 5.089954 -0.470023 -2.855338


%chk=000211612-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211612

0 1
O 0.313165 1.673611 1.946156
N -0.105403 -0.268429 0.704083
N -2.551446 0.459578 -0.057669
C 1.160133 -0.964031 1.025817
C -1.760854 1.537722 0.602601
C 0.878920 -2.429317 1.437116
C 2.165323 -0.805185 -0.129081
C -0.419006 0.986578 1.162915
C -3.399509 0.887820 -1.200560
C -2.523366 2.316420 1.700602
C 0.063707 -2.534264 2.741911
C -4.165518 -0.307913 -1.800366
C 2.828085 0.442291 -0.280682
C 2.437918 -1.836887 -1.061807
C 3.738063 0.653173 -1.338511
C 3.348401 -1.627338 -2.123967
C -5.050563 0.103206 -2.996525
C 4.001608 -0.382620 -2.266616
H 1.564963 -0.421499 1.902934
H -1.469279 2.252625 -0.193679
H 0.341421 -2.952993 0.619817
H 1.848774 -2.948842 1.559519
H -0.790767 -0.654007 0.034336
H -3.117507 -0.048833 0.639868
H -2.734517 1.321970 -1.972413
H -4.130744 1.683550 -0.917527
H -2.866402 1.630526 2.498377
H -1.856210 3.061139 2.165111
H -3.403672 2.832295 1.276151
H 0.615151 -2.087423 3.589800
H -0.151590 -3.588653 2.993713
H -0.899035 -1.998987 2.652559
H -4.798707 -0.769389 -1.013905
H -3.433539 -1.077948 -2.110696
H 2.618744 1.244084 0.438080
H 1.947709 -2.811848 -0.964299
H -5.803182 0.856613 -2.696956
H -4.441269 0.540442 -3.809551
H -5.590458 -0.766988 -3.410822
H 4.244278 1.620189 -1.437602
H 3.550212 -2.436042 -2.836061
H 4.709767 -0.222199 -3.087568


