%chk=000181595.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181595

0 1
O -3.503225 0.473240 -0.000026
O -0.406681 3.434072 0.000937
O 2.626080 -2.901182 -0.001168
O 1.752140 3.264119 0.000692
O 3.863145 -1.123690 -0.001266
N -2.109805 -1.359057 0.000989
N 0.627972 2.795647 0.000370
N 2.788517 -1.692925 -0.000679
C -0.857371 -0.685783 0.000511
C 0.312430 -1.473385 0.000080
C -0.750895 0.722826 0.000586
C 0.516889 1.306519 0.000275
C 1.562627 -0.844722 -0.000236
C 1.693881 0.545826 -0.000140
C -3.391176 -0.732023 0.001292
C -4.529777 -1.704556 0.000252
H 0.266157 -2.569259 0.000011
H -1.656254 1.363213 0.000893
H 2.683995 1.028580 -0.000381
H -2.065382 -2.381404 0.000281
H -4.552069 -2.333426 -0.901637
H -5.490106 -1.155797 0.023121
H -4.529093 -2.368533 0.876444


%chk=000181595-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000181595

0 1
O -3.611813 0.504043 0.004543
O -0.414480 3.505017 -0.000336
O 2.580758 -2.989126 0.001388
O 1.857646 3.304078 -0.000209
O 3.914858 -1.138271 0.001143
N -2.129913 -1.314497 -0.000255
N 0.667702 2.808443 -0.000617
N 2.762366 -1.711041 0.000269
C -0.879600 -0.653450 -0.000178
C 0.289117 -1.458048 0.000046
C -0.753790 0.763047 -0.000384
C 0.539622 1.318464 -0.000368
C 1.552342 -0.841173 0.000046
C 1.720880 0.554869 -0.000151
C -3.417857 -0.741525 -0.000763
C -4.544383 -1.768771 -0.000006
H 0.240780 -2.552135 0.000217
H -1.637581 1.403966 -0.000555
H 2.709180 1.018721 -0.000141
H -2.092083 -2.336887 -0.000039
H -4.516565 -2.393778 -0.911851
H -5.504715 -1.235416 0.031674
H -4.480474 -2.438227 0.877728


