%chk=000229274.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229274

0 1
O -3.260130 1.048841 -0.000994
O -3.198327 -1.104223 0.000496
N 2.903974 -0.001762 -0.000027
N 0.880781 1.241312 0.000614
N 0.881310 -1.233053 0.002353
N -2.643232 -0.005121 -0.000111
N -1.075345 -2.530228 0.002369
C 1.544929 0.007176 0.001359
C -0.465746 1.238510 -0.000060
C -1.208934 0.010819 0.000420
C -0.457560 -1.225372 0.001646
C -1.122316 2.569940 -0.001080
C 3.663764 1.267727 0.002395
C 3.646647 -1.282233 0.004054
H -1.785932 2.692469 0.875152
H -0.402358 3.403417 -0.001030
H -1.784831 2.691625 -0.878259
H 4.748050 1.081539 -0.013135
H 3.417189 1.867713 0.900626
H 3.395139 1.883837 -0.878703
H 3.371231 -1.894731 -0.878352
H 3.383234 -1.882789 0.898031
H 4.732993 -1.112470 -0.004644
H -1.681085 -2.649151 0.823661
H -1.681747 -2.649693 -0.818381


%chk=000229274-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229274

0 1
O -3.360480 1.161857 -0.181116
O -3.357724 -1.108918 -0.179844
N 2.850643 -0.017096 0.112981
N 0.852125 1.220255 -0.000585
N 0.837547 -1.225674 0.020691
N -2.709781 0.041251 -0.152479
N -1.131120 -2.439725 -0.067095
C 1.476580 -0.018379 0.042728
C -0.500220 1.255873 -0.065298
C -1.270242 0.034875 -0.088644
C -0.525279 -1.220301 -0.045151
C -1.090218 2.646194 -0.109925
C 3.626284 1.232736 0.136813
C 3.616768 -1.270921 0.164535
H -1.771735 2.823759 0.739537
H -0.259037 3.367051 -0.087145
H -1.702843 2.798059 -1.014868
H 4.315863 1.269212 -0.728455
H 4.226252 1.291314 1.065329
H 2.931300 2.081757 0.091673
H 2.917253 -2.117313 0.144544
H 4.221247 -1.310660 1.091149
H 4.302281 -1.335617 -0.702185
H -0.535671 -3.265699 -0.032280
H -2.158095 -2.459791 -0.116508


