%chk=000247531.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247531

0 1
O -0.421353 2.687796 -1.168187
O 4.850914 -2.379772 0.542179
N -2.837655 0.149198 -0.097796
N 1.461842 0.857334 0.168107
N 4.137110 -0.232464 0.241927
C -2.294331 1.508391 -0.411125
C -0.784891 1.371920 -0.703814
C 0.022314 1.002457 0.558106
C -3.207355 -0.579176 -1.357909
C -4.015033 0.249228 0.828537
C -3.682029 -2.001365 -1.017411
C -4.504625 -1.160399 1.201205
C -4.871673 -1.967510 -0.050106
C 1.735058 -0.514807 -0.376425
C 2.363432 1.145058 1.332352
C 3.200095 -0.602432 -0.849893
C 3.832635 1.081466 0.858423
C 4.831361 -1.227682 0.944503
H -2.439885 2.198613 0.446818
H -2.781858 2.008663 -1.276922
H -0.588139 0.659624 -1.535557
H -0.417172 0.089668 1.019905
H -0.086418 1.816208 1.306351
H -2.301618 -0.631662 -1.999861
H -3.989006 -0.049827 -1.944680
H -4.852212 0.837913 0.395766
H -3.681568 0.779707 1.746529
H -2.846988 -2.568963 -0.560182
H -3.952306 -2.535547 -1.946132
H -5.371819 -1.084250 1.881657
H -3.708956 -1.688877 1.763629
H -5.754478 -1.522160 -0.546391
H -5.163623 -2.996001 0.231593
H 1.058204 -0.684615 -1.242266
H 1.524141 -1.322608 0.357883
H 2.205771 0.452191 2.186086
H 2.141737 2.171549 1.697629
H 3.373968 0.088136 -1.705162
H 3.431378 -1.637544 -1.197249
H 4.520160 1.287608 1.704070
H 4.012750 1.870798 0.089695
H 0.558693 2.772500 -1.182769
H 5.406728 -0.876068 1.814287


%chk=000247531-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247531

0 1
O -0.091638 2.255457 -1.246410
O 5.891190 -1.653330 -0.026467
N -2.980651 0.124864 -0.124409
N 1.486147 0.625863 0.263005
N 4.280973 0.025651 0.310509
C -2.211277 1.335295 -0.512132
C -0.728565 1.021604 -0.775860
C 0.013845 0.544772 0.496917
C -3.383815 -0.689623 -1.302935
C -4.155941 0.444751 0.729462
C -4.046206 -2.012283 -0.868083
C -4.839525 -0.842568 1.233310
C -5.261208 -1.738278 0.046456
C 2.019017 -0.532536 -0.510322
C 2.274458 0.845106 1.503852
C 3.491140 -0.291292 -0.894337
C 3.751330 1.115737 1.147012
C 5.414728 -0.694039 0.643336
H -2.261836 2.073527 0.310501
H -2.629588 1.834434 -1.419150
H -0.650541 0.240243 -1.565045
H -0.329408 -0.470526 0.789074
H -0.231353 1.241061 1.321053
H -2.488438 -0.899003 -1.916116
H -4.099027 -0.115996 -1.951473
H -4.908936 1.061104 0.168869
H -3.806923 1.051060 1.586048
H -3.301426 -2.623381 -0.322103
H -4.353354 -2.581159 -1.766816
H -5.716934 -0.575195 1.853293
H -4.127003 -1.394080 1.877133
H -6.052335 -1.224377 -0.538246
H -5.695381 -2.688188 0.411569
H 1.419564 -0.654617 -1.429117
H 1.939149 -1.475836 0.081368
H 2.216910 -0.036934 2.187824
H 1.858663 1.720266 2.034873
H 3.553605 0.553105 -1.609063
H 3.937157 -1.186701 -1.359379
H 4.360663 1.198842 2.065321
H 3.814236 2.075219 0.594949
H 0.867383 2.144486 -0.963134
H 5.874449 -0.330206 1.592264


