%chk=000244870.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244870

0 1
O 2.666406 -2.594138 -1.743189
O 2.857054 -3.547036 0.422405
O -1.438885 1.187999 1.849756
O 2.889329 3.201975 0.768202
O 3.724463 2.634159 -1.147623
N 2.800117 2.807490 -0.377218
C 0.612226 1.625561 0.033721
C -0.848483 1.516789 -0.443690
C 1.222581 0.243968 0.159710
C 1.411675 2.534264 -0.920245
C 1.650623 -0.455829 -1.000093
C 1.325591 -0.325692 1.429566
C -1.769569 1.088878 0.687720
C 2.179071 -1.707585 -0.792066
C 2.291100 -2.282134 0.510670
C 1.870262 -1.614441 1.637488
C -3.101448 0.534370 0.297462
C 3.126772 -3.771942 -1.000528
C -3.752351 0.905811 -0.887648
C -3.713899 -0.376450 1.173098
C -5.001101 0.361723 -1.197579
C -4.959490 -0.924759 0.856390
C -5.602889 -0.556310 -0.328926
H 0.611604 2.118037 1.052735
H -0.923382 0.801485 -1.289137
H -1.207762 2.490385 -0.835166
H 0.895769 3.512452 -1.046977
H 1.504183 2.085406 -1.935217
H 1.573127 -0.027549 -1.994167
H 0.966050 0.230016 2.301946
H 1.949692 -2.043031 2.632820
H 4.214602 -3.848245 -1.130197
H 2.524985 -4.630283 -1.325867
H -3.298273 1.624058 -1.568530
H -3.209507 -0.646789 2.105144
H -5.508016 0.652726 -2.116495
H -5.429199 -1.635114 1.535853
H -6.575524 -0.981823 -0.576228


%chk=000244870-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244870

0 1
O 2.435972 -2.754065 -1.840058
O 3.155984 -3.567705 0.298523
O -1.488844 0.890370 1.898024
O 2.834294 3.130848 1.025566
O 3.729636 2.824674 -1.050082
N 2.743589 2.850057 -0.225643
C 0.580608 1.556609 0.121584
C -0.877200 1.442142 -0.396404
C 1.273913 0.193991 0.208906
C 1.350767 2.545955 -0.781486
C 1.493123 -0.580061 -0.972213
C 1.702392 -0.296841 1.465739
C -1.840803 0.916102 0.683078
C 2.139231 -1.806301 -0.825902
C 2.563573 -2.285230 0.432443
C 2.355330 -1.553042 1.601685
C -3.215600 0.474624 0.271861
C 3.273147 -3.784124 -1.167556
C -3.681129 0.556555 -1.068982
C -4.085398 -0.033745 1.276000
C -4.988219 0.138307 -1.397185
C -5.387974 -0.454781 0.947023
C -5.843313 -0.369865 -0.391586
H 0.542029 1.986769 1.137771
H -0.924816 0.793493 -1.290366
H -1.259935 2.437057 -0.712244
H 0.834391 3.522902 -0.821820
H 1.519665 2.174367 -1.803989
H 1.177226 -0.236329 -1.962675
H 1.518020 0.307153 2.359124
H 2.679264 -1.927734 2.575555
H 4.328244 -3.643471 -1.469917
H 2.881037 -4.782110 -1.415571
H -3.033473 0.948092 -1.860360
H -3.710725 -0.086286 2.303578
H -5.340183 0.205808 -2.432212
H -6.049520 -0.848261 1.726246
H -6.856797 -0.697523 -0.648553


