%chk=000182791.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182791

0 1
O 7.107926 -0.187968 -0.622872
N 4.376542 -0.494436 0.157120
N 0.746456 -0.116739 1.153528
N -1.710091 2.480124 -1.150168
C 2.897383 -0.545108 -0.069507
C 4.931524 0.852215 -0.205332
C 5.079048 -1.561153 -0.630824
C 2.219256 0.006851 1.206518
C 6.436853 0.860159 0.105524
C 6.581545 -1.493333 -0.310776
C -0.033878 0.721174 0.350873
C -1.442197 0.371596 0.143680
C -2.241445 1.292827 -0.619740
C -2.042461 -0.789183 0.644248
C -3.397798 -1.068147 0.410613
C -4.187962 -0.148271 -0.353294
C 0.452138 1.895446 -0.196581
C -3.598978 1.017777 -0.856431
C -0.431855 2.745705 -0.932187
C -4.024084 -2.264907 0.923843
C -5.582655 -0.454843 -0.582675
C -5.341585 -2.517525 0.685954
C -6.134957 -1.594807 -0.082075
H 2.560282 0.022849 -0.963470
H 2.576860 -1.595768 -0.235544
H 4.416459 1.622794 0.406057
H 4.767839 1.114668 -1.273213
H 4.924222 -1.463441 -1.726964
H 4.675710 -2.549225 -0.323410
H 2.583257 -0.548794 2.102298
H 2.501516 1.071408 1.372195
H 6.936866 1.769265 -0.271819
H 6.633548 0.731459 1.184539
H 6.783981 -1.718511 0.751317
H 7.177783 -2.152750 -0.965369
H 0.389897 -1.052118 1.342667
H -1.457992 -1.496725 1.234095
H 1.483061 2.203835 -0.073598
H -4.185076 1.732529 -1.438431
H -0.039503 3.681309 -1.353997
H -3.413681 -2.954248 1.504983
H -6.170962 0.253572 -1.165064
H -5.824392 -3.415397 1.067866
H -7.184301 -1.835365 -0.248476


%chk=000182791-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000182791

0 1
O 7.294982 0.031269 -0.463018
N 4.495337 -0.519966 0.111291
N 0.756319 -0.329314 0.854234
N -1.763247 2.432951 -1.264929
C 3.044194 -0.653895 -0.151214
C 4.994770 0.873114 -0.048702
C 5.316824 -1.448533 -0.711781
C 2.200362 -0.165058 1.056613
C 6.479051 0.949335 0.347229
C 6.794625 -1.344198 -0.301422
C -0.051554 0.557750 0.160335
C -1.487972 0.294938 0.038600
C -2.294020 1.271956 -0.691643
C -2.124209 -0.841658 0.586600
C -3.519119 -1.063774 0.444786
C -4.320266 -0.090949 -0.287047
C 0.448088 1.731799 -0.435685
C -3.683386 1.049569 -0.833425
C -0.440232 2.617845 -1.117338
C -4.169840 -2.221217 1.001998
C -5.735678 -0.323348 -0.428091
C -5.539930 -2.413589 0.846540
C -6.331153 -1.454000 0.123270
H 2.726247 -0.114110 -1.076594
H 2.820879 -1.725158 -0.313810
H 4.415919 1.554346 0.602109
H 4.878349 1.222649 -1.105809
H 5.225560 -1.221497 -1.803565
H 4.962811 -2.483653 -0.546014
H 2.504782 -0.745601 1.945226
H 2.416810 0.896116 1.280489
H 6.889096 1.954827 0.156799
H 6.588507 0.697942 1.424339
H 6.908881 -1.662007 0.757525
H 7.432742 -1.968700 -0.948154
H 0.329810 -1.172297 1.232879
H -1.558777 -1.597869 1.147932
H 1.510761 1.984039 -0.396264
H -4.255670 1.801329 -1.387151
H -0.030024 3.529664 -1.570599
H -3.567422 -2.953179 1.554134
H -6.335766 0.409837 -0.979551
H -6.025370 -3.297580 1.274421
H -7.407968 -1.621321 0.010560


