%chk=000236521.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236521

0 1
O -3.603856 -0.556351 -0.352577
O -2.469459 -2.607615 1.053029
O -2.021753 1.850806 -0.757820
O 2.125940 -0.131325 2.595949
N 2.678156 -0.011151 0.333906
N 4.027929 0.082097 0.585755
C 0.357579 -0.218164 0.965671
C -2.320877 -0.444962 0.157116
C -1.671554 -1.510718 0.838735
C -1.590531 0.732074 -0.101970
C -0.337292 -1.401482 1.244211
C -0.238258 0.843746 0.300105
C 1.790827 -0.112083 1.437003
C -4.625232 -0.867128 0.635997
C 4.894575 0.190525 -0.383219
C -1.901561 -3.720809 1.791809
C -3.399439 1.904512 -1.215503
C 6.332444 0.281955 0.031402
C 4.609208 0.233876 -1.855547
H 0.161972 -2.204907 1.779684
H 0.291406 1.773837 0.099219
H 2.308985 0.001789 -0.622789
H -4.626770 -0.119317 1.431049
H -4.458823 -1.875494 1.035500
H -5.539219 -0.826530 0.034665
H -1.618090 -3.404545 2.800176
H -1.056416 -4.147294 1.243566
H -2.746580 -4.420913 1.817450
H -3.607465 1.064244 -1.888986
H -3.419230 2.866370 -1.740326
H -4.076178 1.892138 -0.357119
H 6.781023 1.224844 -0.309115
H 6.916375 -0.549441 -0.385392
H 6.451138 0.244363 1.128323
H 4.106052 -0.680739 -2.198821
H 5.526436 0.327630 -2.453121
H 3.976141 1.092258 -2.120715


%chk=000236521-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236521

0 1
O -3.646355 -0.699057 -0.415540
O -2.725674 -2.608567 1.402211
O -1.778758 1.335882 -1.361771
O 2.249945 -1.410063 2.205777
N 2.791067 -0.191329 0.268918
N 4.150709 -0.134362 0.572896
C 0.446921 -0.710285 0.737715
C -2.322417 -0.667359 0.052983
C -1.797886 -1.658791 0.944919
C -1.431494 0.314357 -0.469258
C -0.434513 -1.670783 1.291349
C -0.055836 0.281167 -0.131064
C 1.892125 -0.803424 1.158801
C -4.730895 -0.650009 0.590924
C 4.953391 0.404836 -0.323017
C -2.213888 -3.694810 2.246910
C -3.137180 1.909093 -1.360354
C 6.420302 0.460468 0.034316
C 4.510540 0.966131 -1.668724
H -0.011795 -2.405117 1.981826
H 0.561773 1.095582 -0.523331
H 2.429654 0.159561 -0.626749
H -4.677375 0.295017 1.167068
H -4.668306 -1.513928 1.270810
H -5.662828 -0.682643 0.006188
H -1.795914 -3.303553 3.193582
H -1.441708 -4.280362 1.713622
H -3.087720 -4.329044 2.456214
H -3.858159 1.220945 -1.827268
H -3.042479 2.836887 -1.946436
H -3.465257 2.149579 -0.330801
H 6.787640 1.505459 0.039960
H 7.029386 -0.092231 -0.707646
H 6.582560 0.019030 1.029868
H 4.027646 0.191858 -2.298996
H 5.373593 1.357677 -2.229483
H 3.786788 1.798283 -1.549121


