%chk=000298942.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298942

0 1
O -0.105474 -2.001680 -1.189647
O 3.132278 2.537027 1.913359
O 1.103250 1.976027 1.440505
O -3.166395 3.099680 -1.791493
O -4.535878 -2.892126 1.593528
O -5.158780 2.739603 -1.012141
O -6.130860 -1.461260 1.255437
O 6.672198 -1.683678 -0.810660
O 6.917787 0.097681 0.398278
N 0.576552 -0.135278 0.011961
N 2.322894 1.806122 1.382130
N -3.999508 2.434621 -1.206365
N -4.982480 -1.846013 1.163945
N 6.242746 -0.731430 -0.184335
C 1.972128 -0.288598 -0.037000
C -1.795519 -0.515287 -0.368558
C 2.820151 0.653154 0.625768
C -0.391659 -0.995936 -0.587468
C -2.697218 -1.367459 0.284091
C -2.214088 0.726911 -0.858744
C 2.575175 -1.364894 -0.739570
C -3.550878 1.115270 -0.678915
C -4.024528 -0.948782 0.458956
C 4.220980 0.497072 0.570560
C 4.775594 -0.569582 -0.127435
C -4.470828 0.290868 -0.018721
C 3.946373 -1.508717 -0.788398
H 0.217439 0.686274 0.568033
H -2.379209 -2.355073 0.655093
H -1.519962 1.399692 -1.385855
H 1.938306 -2.102080 -1.255030
H 4.874287 1.227683 1.085200
H -5.520481 0.608211 0.120233
H 4.411408 -2.343625 -1.333541


%chk=000298942-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298942

0 1
O -0.172547 -2.319412 -0.244355
O 3.252079 3.154112 0.439553
O 1.106978 2.416786 0.380198
O -2.899797 3.476972 -0.344319
O -4.884701 -3.371440 0.253007
O -5.112792 2.948693 -0.148093
O -6.468100 -1.727075 0.203048
O 6.754807 -1.969633 -0.328722
O 7.025186 0.277550 -0.015431
N 0.615710 -0.116863 0.020629
N 2.401785 2.204322 0.324503
N -3.866027 2.636448 -0.206787
N -5.248568 -2.139151 0.182615
N 6.295963 -0.776601 -0.153815
C 2.001576 -0.306249 -0.024232
C -1.806628 -0.548168 -0.063254
C 2.889305 0.823599 0.123526
C -0.391996 -1.081246 -0.107243
C -2.832349 -1.520229 0.036327
C -2.149115 0.824087 -0.140329
C 2.597267 -1.590723 -0.215268
C -3.510728 1.187797 -0.110538
C -4.174007 -1.106009 0.070008
C 4.290408 0.669883 0.081031
C 4.821845 -0.610801 -0.109046
C -4.550380 0.248186 -0.000675
C 3.987568 -1.744149 -0.258207
H 0.367044 0.879431 0.181578
H -2.571691 -2.581824 0.080810
H -1.417139 1.632587 -0.241929
H 1.936970 -2.451823 -0.324973
H 4.944687 1.538045 0.194151
H -5.599256 0.554808 0.023628
H 4.442443 -2.727512 -0.404195


