%chk=000291307.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291307

0 1
O 1.458237 -1.482540 -0.277286
N -0.658147 -0.339530 -0.171153
N 4.148955 -1.576456 0.162013
C -0.046899 0.990509 -0.491772
C -2.113719 -0.396624 -0.514763
C 1.445111 0.941047 -0.305112
C 0.101424 -1.446188 -0.807065
C 2.099448 -0.276346 -0.189815
C -2.913336 0.328224 0.584968
C 3.524623 -0.343093 0.045012
C 2.191583 2.147628 -0.211182
C 4.238841 0.884790 0.145600
C -4.388398 0.127862 0.374199
C 3.547765 2.125817 0.004671
C 5.648968 0.811917 0.385928
C -5.118066 1.026451 -0.419171
C -5.043318 -0.964506 0.963706
C 6.256700 -0.411043 0.505734
C 5.458855 -1.597443 0.383481
C -6.488118 0.834149 -0.616694
C -6.413239 -1.152043 0.763056
C -7.138544 -0.254272 -0.027001
H -0.488475 1.724098 0.224726
H -0.286046 1.349129 -1.518791
H -2.346105 0.042303 -1.509020
H -2.437422 -1.461532 -0.552539
H -0.286313 -2.431620 -0.471685
H 0.198886 -1.387840 -1.909500
H -2.660337 1.406678 0.603107
H -2.596511 -0.052138 1.581145
H 1.663520 3.096375 -0.309302
H 4.115723 3.050703 0.076522
H 6.215967 1.738492 0.471211
H -4.619159 1.875972 -0.879913
H -4.484106 -1.665682 1.580665
H 7.323944 -0.505982 0.690301
H 5.931147 -2.583529 0.473707
H -7.050488 1.535227 -1.231232
H -6.917286 -1.999779 1.224634
H -8.205168 -0.401582 -0.180991


%chk=000291307-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000291307

0 1
O 1.451868 -1.514206 -0.378461
N -0.651904 -0.314561 -0.353743
N 4.139422 -1.602894 0.198215
C -0.040692 1.013180 -0.562170
C -2.113022 -0.388811 -0.545868
C 1.467774 0.942279 -0.352453
C 0.122888 -1.358053 -1.012099
C 2.122849 -0.297986 -0.226956
C -2.901358 0.354593 0.568674
C 3.538121 -0.362244 0.062867
C 2.225047 2.148168 -0.232793
C 4.272184 0.881800 0.192545
C -4.399914 0.143303 0.416838
C 3.593273 2.131952 0.030213
C 5.673239 0.790647 0.479762
C -5.169841 0.975759 -0.436581
C -5.052405 -0.923828 1.087265
C 6.271266 -0.463004 0.619645
C 5.459226 -1.632453 0.468386
C -6.553473 0.750367 -0.615993
C -6.435975 -1.152832 0.912557
C -7.191690 -0.316514 0.058202
H -0.466763 1.724041 0.169248
H -0.271175 1.422300 -1.582119
H -2.428410 0.017573 -1.539763
H -2.407350 -1.455081 -0.525872
H -0.371193 -2.334006 -0.897633
H 0.318335 -1.149658 -2.094271
H -2.668838 1.435738 0.526917
H -2.542364 -0.023995 1.542692
H 1.700457 3.106291 -0.338584
H 4.156666 3.067290 0.123575
H 6.258512 1.711699 0.585888
H -4.683381 1.811308 -0.956222
H -4.472850 -1.572935 1.755879
H 7.338625 -0.566254 0.839223
H 5.906008 -2.629024 0.571343
H -7.133268 1.406298 -1.275492
H -6.924330 -1.977607 1.444082
H -8.265065 -0.491036 -0.076545


