%chk=000115697.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000115697

0 1
O -1.043835 -0.943585 -0.645997
O -0.296361 -0.567088 1.494363
N -4.433113 0.165644 0.367382
C 0.114251 -0.495418 0.107890
C -2.241205 -0.898089 0.172883
C 0.446307 0.929295 -0.286438
C 1.245197 -1.487006 -0.078451
C -1.737729 -0.615970 1.597158
C 1.376174 1.653828 0.481678
C 2.547522 -1.283013 0.406268
C 2.063353 0.971987 1.628998
C 3.072538 -0.060785 1.118249
C -3.148304 0.206134 -0.399616
C -0.143154 1.517152 -1.409601
C 0.933787 -2.680790 -0.758187
C 1.670145 2.980699 0.139879
C 3.510770 -2.296396 0.193455
C 0.158876 2.838973 -1.750612
C 1.893956 -3.666258 -0.965201
C 1.057842 3.571071 -0.969631
C 3.193128 -3.470826 -0.480819
C -5.411708 -0.761148 -0.275486
C -5.019906 1.532084 0.498076
H -2.687443 -1.907405 0.057912
H -2.072014 0.351299 2.006928
H -1.944764 -1.426538 2.313827
H 2.582605 1.703709 2.278461
H 1.310001 0.479692 2.291166
H 3.683935 -0.394270 1.986766
H 3.784767 0.448534 0.427886
H -3.265086 0.056156 -1.493784
H -2.647315 1.192618 -0.283885
H -0.833832 0.931001 -2.020078
H -0.085412 -2.826127 -1.130783
H 2.380229 3.551397 0.733847
H 4.524985 -2.156147 0.564322
H -0.301664 3.293598 -2.624273
H 1.637827 -4.579991 -1.495458
H 1.289250 4.602776 -1.229812
H 3.952157 -4.236661 -0.632216
H -4.968049 -1.766555 -0.349533
H -5.747549 -0.458699 -1.278223
H -6.298136 -0.846337 0.374162
H -5.934844 1.470365 1.109784
H -5.274620 2.021481 -0.453102
H -4.311858 2.177009 1.043747


%chk=000115697-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000115697

0 1
O -1.051216 -0.715690 -0.730874
O -0.319395 -0.540138 1.495494
N -4.587637 0.147230 0.308795
C 0.149340 -0.402167 0.083174
C -2.253545 -0.712863 0.150110
C 0.584347 1.045202 -0.211000
C 1.234570 -1.464874 -0.149694
C -1.736694 -0.120785 1.475898
C 1.561194 1.673790 0.614265
C 2.559497 -1.369867 0.374547
C 2.241504 0.900213 1.728758
C 3.166523 -0.211052 1.177450
C -3.360090 0.112931 -0.523723
C 0.022387 1.753774 -1.298299
C 0.868891 -2.607578 -0.909466
C 1.920919 3.015672 0.342225
C 3.454700 -2.445584 0.117280
C 0.399306 3.089265 -1.564971
C 1.775185 -3.655503 -1.158328
C 1.346585 3.727941 -0.735311
C 3.084896 -3.575841 -0.635131
C -5.363505 -1.110569 0.247642
C -5.434295 1.323104 0.014391
H -2.558262 -1.768176 0.287985
H -1.824047 0.983431 1.482106
H -2.210496 -0.544054 2.372057
H 2.860124 1.590031 2.332647
H 1.486473 0.448915 2.394440
H 3.716397 -0.652757 2.032126
H 3.935549 0.267850 0.535504
H -3.550331 -0.291424 -1.549247
H -2.987347 1.146633 -0.643223
H -0.704834 1.241754 -1.934570
H -0.146408 -2.646962 -1.311010
H 2.665180 3.503953 0.983401
H 4.472462 -2.381329 0.523845
H -0.043051 3.623664 -2.413258
H 1.463413 -4.521749 -1.752277
H 1.640931 4.766127 -0.927068
H 3.807249 -4.380888 -0.811588
H -4.741376 -1.966216 0.560937
H -5.759085 -1.328413 -0.777057
H -6.221003 -1.048424 0.940857
H -6.288237 1.347569 0.715072
H -5.844693 1.325935 -1.027165
H -4.850373 2.249321 0.156152


