%chk=000228099.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228099

0 1
O 3.314198 1.721138 0.001145
N 0.908557 0.401435 0.268386
N 2.056438 -0.282612 -0.076116
N 4.379829 -0.232941 -0.569868
C -1.469075 0.713342 0.604857
C -0.271088 -0.121775 0.103553
C -0.585764 -1.452674 -0.538689
C -2.410670 0.937471 -0.584528
C -2.122884 -0.074253 1.755218
C -1.044079 2.091036 1.143615
C -0.240936 -2.634740 0.379976
C -1.821615 1.681074 -1.745773
C -3.683952 0.536509 -0.608439
C -0.472162 -3.971775 -0.317880
C 3.238043 0.527439 -0.183172
H -1.661581 -1.503320 -0.815563
H -0.051340 -1.542888 -1.506260
H -2.955142 0.488939 2.193528
H -2.513897 -1.043011 1.427578
H -1.399716 -0.260231 2.558417
H -0.399516 1.992270 2.026833
H -0.455647 2.657605 0.409676
H -1.913467 2.693917 1.420411
H -0.856710 -2.578952 1.300979
H 0.808016 -2.566368 0.727774
H -2.239401 1.349528 -2.704434
H -2.032574 2.757518 -1.656236
H -0.730063 1.580007 -1.812887
H -4.178170 0.012899 0.192741
H -4.341194 0.717827 -1.445411
H -0.240713 -4.810764 0.349125
H -1.515718 -4.088105 -0.634624
H 0.152916 -4.081704 -1.210873
H 1.999602 -1.142978 -0.638733
H 4.448929 -1.207841 -0.320711
H 5.264745 0.258576 -0.484116


%chk=000228099-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000228099

0 1
O 3.461040 1.615965 0.258998
N 0.876076 0.496364 0.212553
N 2.001322 -0.188381 -0.224473
N 4.300792 -0.378203 -0.611193
C -1.522715 0.739734 0.595159
C -0.303497 -0.080856 0.108385
C -0.532790 -1.474176 -0.471136
C -2.440273 0.998334 -0.631975
C -2.244505 -0.064001 1.713323
C -1.077271 2.103806 1.194720
C -0.139626 -2.641355 0.484741
C -1.850764 1.853435 -1.744864
C -3.707899 0.513676 -0.731360
C -0.288674 -4.018306 -0.196735
C 3.265352 0.446599 -0.156557
H -1.596207 -1.578443 -0.750344
H 0.034414 -1.587790 -1.422998
H -3.115617 0.503740 2.087486
H -2.605110 -1.048847 1.366248
H -1.552735 -0.227362 2.558797
H -0.446912 1.942848 2.085864
H -0.473359 2.688524 0.484234
H -1.970232 2.687841 1.484514
H -0.780061 -2.599260 1.384960
H 0.899109 -2.511222 0.848495
H -2.479082 1.816090 -2.651279
H -1.771707 2.912053 -1.432831
H -0.827271 1.529097 -2.009845
H -4.179171 -0.084832 0.054412
H -4.325344 0.728657 -1.612115
H -0.026952 -4.839355 0.495202
H -1.328233 -4.181370 -0.537173
H 0.368408 -4.101258 -1.083879
H 1.925991 -1.124039 -0.643421
H 4.182128 -1.347279 -0.899397
H 5.235575 0.021170 -0.597017


