%chk=000252772.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000252772

0 1
O -2.759442 -1.548713 -0.002523
N 3.374238 0.335303 0.001310
N -2.209057 0.692822 0.000068
C 1.289835 -0.623787 -0.001353
C 1.997191 0.627864 0.001467
C -0.776698 0.592850 0.000540
C -0.115453 -0.630341 -0.001824
C 1.318735 1.861346 0.003825
C 2.280221 -1.667429 -0.003197
C -0.061921 1.834767 0.003366
C 3.526646 -1.064365 -0.001562
C -3.115835 -0.387739 -0.001078
C -4.560440 0.038157 -0.000668
H -0.658159 -1.581066 -0.003957
H 1.866164 2.799158 0.005951
H 2.067693 -2.717593 -0.005431
H 4.112949 1.007940 0.002868
H -0.616141 2.770630 0.005170
H 4.501779 -1.520334 -0.002185
H -2.581904 1.642516 0.001855
H -4.827216 0.621615 0.889498
H -5.207888 -0.855505 -0.001667
H -4.826998 0.623505 -0.889675


%chk=000252772-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000252772

0 1
O -2.856061 -1.623109 -0.003740
N 3.388734 0.346588 0.000965
N -2.220349 0.638228 0.000895
C 1.323701 -0.639538 -0.001129
C 2.015427 0.623486 0.001319
C -0.792457 0.554458 0.000871
C -0.094940 -0.673983 -0.001369
C 1.318659 1.851324 0.003547
C 2.335288 -1.676398 -0.002945
C -0.085453 1.802169 0.003296
C 3.577507 -1.043953 -0.001620
C -3.159078 -0.392596 -0.001082
C -4.610558 0.097643 -0.000802
H -0.650985 -1.612679 -0.003211
H 1.839826 2.814660 0.005432
H 2.165795 -2.751356 -0.004963
H 4.130856 1.042167 0.002326
H -0.653823 2.741549 0.005020
H 4.578016 -1.472862 -0.002304
H -2.598746 1.588320 0.002527
H -4.830073 0.706478 0.896104
H -5.273718 -0.778985 -0.002825
H -4.829268 0.709991 -0.895514


