%chk=000207677.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207677

0 1
O 0.156030 -1.493492 -0.573514
O 0.040195 2.273871 0.989539
N 1.122059 1.098859 -0.642811
N -4.862652 0.903186 -0.039009
C -1.165244 0.472571 -0.027620
C -1.082492 -0.896023 -0.334671
C -2.425619 1.057706 0.105550
C -3.591312 0.281411 -0.074305
C -2.230358 -1.681361 -0.506375
C 0.034197 1.352552 0.183991
C -3.485596 -1.094533 -0.381232
C 2.379372 1.868721 -0.500006
C 0.817145 -1.983797 0.641520
C 3.519800 0.998856 -0.046029
C 2.156247 -2.442696 0.157164
C 4.794273 1.304538 -0.277076
C 3.139621 -2.804810 0.976077
H -2.494259 2.120649 0.351060
H -2.124556 -2.738032 -0.750799
H -4.382029 -1.692759 -0.532158
H 1.156070 0.255505 -1.223172
H 2.602119 2.358207 -1.476974
H 2.224134 2.698299 0.241390
H 0.875828 -1.158325 1.374150
H 0.206752 -2.810467 1.048854
H -5.647396 0.301430 0.165524
H -4.915722 1.778135 0.464635
H 3.233583 0.100495 0.506999
H 2.254891 -2.459824 -0.933310
H 5.618313 0.695083 0.065652
H 5.118319 2.182019 -0.817753
H 4.104026 -3.144615 0.623105
H 3.066661 -2.796060 2.054401


%chk=000207677-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207677

0 1
O 0.299052 -1.384816 -0.574973
O -0.226589 2.848090 0.083157
N 1.249728 1.150205 -0.523517
N -4.846464 0.862006 0.260193
C -1.129009 0.602058 -0.164489
C -0.987876 -0.807078 -0.324007
C -2.426499 1.132884 0.023310
C -3.580132 0.308070 0.064271
C -2.130109 -1.637285 -0.302958
C -0.004249 1.620512 -0.186653
C -3.413886 -1.097593 -0.108158
C 2.423093 2.036405 -0.579590
C 0.794402 -2.332404 0.472788
C 3.460556 1.677804 0.467934
C 1.967823 -3.075896 -0.104207
C 4.758689 1.389742 0.199519
C 3.202499 -3.090910 0.455409
H -2.497433 2.220369 0.143598
H -2.012523 -2.714845 -0.464335
H -4.288546 -1.759087 -0.100810
H 1.337019 0.142774 -0.725066
H 2.875924 2.001800 -1.589216
H 2.041104 3.060660 -0.407457
H 1.075012 -1.756445 1.376497
H -0.028950 -3.026448 0.734104
H -5.675713 0.276786 0.283249
H -4.959781 1.864412 0.376463
H 3.096807 1.674918 1.506191
H 1.767869 -3.632082 -1.030174
H 5.475237 1.160069 0.996032
H 5.143432 1.383841 -0.828455
H 4.023617 -3.667790 0.016205
H 3.428297 -2.525427 1.367942


