%chk=000191873.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191873

0 1
O 4.470201 0.707320 -0.517377
O 3.797947 -1.897993 -0.064270
O -2.802481 -1.560125 -1.020949
O -4.874061 -0.673091 -0.698467
N -1.787192 0.163994 0.782445
C -0.303345 2.020343 -0.029860
C -1.447463 1.613615 0.907432
C 0.821159 1.025213 -0.021634
C 0.516264 -0.332361 0.200945
C -0.874184 -0.723482 0.439722
C -3.173679 -0.219311 0.939580
C 2.142783 1.422824 -0.273298
C 1.525141 -1.313106 0.176696
C 3.141838 0.452197 -0.290404
C 2.840407 -0.921548 -0.062749
C -3.706547 -0.922761 -0.483589
H -0.681023 2.113474 -1.077953
H 0.048197 3.036632 0.245871
H -1.177600 1.814404 1.972357
H -2.355112 2.225731 0.683167
H -1.167660 -1.789599 0.282406
H -3.333323 -0.999654 1.701377
H -3.853241 0.615926 1.162220
H 2.380495 2.467924 -0.455799
H 1.298647 -2.370503 0.333839
H 4.638967 1.665702 -0.709551
H 4.697967 -1.516965 -0.279055


%chk=000191873-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191873

0 1
O 4.459785 0.685079 -0.658875
O 3.883100 -1.876274 -0.033118
O -2.548779 -1.067253 -1.331255
O -4.796009 -0.448805 -0.923679
N -1.799067 0.135303 0.985328
C -0.419267 1.946267 -0.063096
C -1.447383 1.590045 1.027732
C 0.770243 1.002906 0.001625
C 0.505047 -0.361454 0.338244
C -0.856558 -0.756574 0.638658
C -3.192998 -0.260596 0.898477
C 2.080652 1.386939 -0.337920
C 1.549479 -1.326389 0.315319
C 3.113878 0.426178 -0.342773
C 2.853735 -0.936443 -0.018269
C -3.560036 -0.622813 -0.662696
H -0.901028 1.856977 -1.057260
H -0.110008 2.998812 0.064409
H -1.040648 1.809108 2.034180
H -2.378422 2.163229 0.894812
H -1.139367 -1.810598 0.642438
H -3.376105 -1.198426 1.451723
H -3.865082 0.527852 1.263020
H 2.294574 2.428409 -0.610322
H 1.357506 -2.376988 0.553083
H 4.616573 1.623916 -0.920311
H 4.729284 -1.433608 -0.306374


