%chk=000162840.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162840

0 1
 O    2.226500       1.944500     -0.4129000    
 O   1.0800000E-02  0.7823000       1.893100    
 O    1.500200      -3.198300      -1.119500    
 O    3.297000       1.793100       1.626300    
 O    5.754900      -1.821200       1.422700    
 O   -8.121700      0.9645000      0.8217000    
 N   0.4403000     -9.6299998E-02 -0.2180000    
 N    2.683300      -1.622600      0.1438000    
 N    5.165400      0.1737000      0.4678000    
 C   0.2586000      -1.508600      8.2599998E-02
 C  -0.9948000      -2.041700     -0.5916000    
 C   0.9643000       2.228500      0.2191000    
 C   3.9999999E-02   2.863300     -0.8071000    
 C   -2.245400      -1.305300     -0.1121000    
 C   0.4061000      0.9075000      0.7367000    
 C   -3.498400      -1.818900     -0.8246000    
 C    1.537400      -2.199900     -0.4044000    
 C   -1.346700       3.115600     -0.2110000    
 C   0.6319000       4.169800      -1.341300    
 C   -4.733600      -1.075200     -0.3853000    
 C    4.411400       1.069000     -0.4127000    
 C    3.274200       1.640500      0.4120000    
 C    3.998600      -1.905800     -0.1436000    
 C   -5.462900      -1.545300      0.6967000    
 C   -5.120900      6.7400001E-02  -1.069400    
 C    5.293600       2.191200     -0.9354000    
 C    5.037500      -1.188000      0.6465000    
 C   -6.605700     -0.8569000       1.104000    
 C   -6.263700      0.7557000     -0.6621000    
 C   -7.006100      0.2935000      0.4246000    
 C    4.467800      -2.775800      -1.046800    
 H   0.1943000      -1.649100       1.168300    
 H   -1.098900      -3.114300     -0.3857000    
 H  -0.9083000      -1.938700      -1.681500    
 H    1.120000       2.909300       1.065900    
 H  -7.8100003E-02   2.195800      -1.670500    
 H   -2.353200      -1.428300      0.9730000    
 H   -2.150900     -0.2302000     -0.3015000    
 H   0.7426000      0.1406000      -1.158700    
 H   -3.627300      -2.892200     -0.6338000    
 H   -3.381400      -1.722200      -1.911800    
 H   -1.286900       3.755900      0.6758000    
 H   -1.994600       3.614200     -0.9403000    
 H   -1.842800       2.183500      7.4500002E-02
 H   0.7950000       4.890900     -0.5330000    
 H  -4.1800000E-02   4.630100      -2.072000    
 H    1.590200       3.998300      -1.842300    
 H    4.005100      0.4859000      -1.244700    
 H    2.541000     -0.8996000      0.8447000    
 H    5.858000      0.6225000       1.060400    
 H   -5.157800      -2.439100       1.233500    
 H   -4.547900      0.4367000      -1.915000    
 H    4.728100       2.858200      -1.594700    
 H    5.695300       2.798800     -0.1163000    
 H    6.141900       1.788700      -1.498800    
 H   -7.175100      -1.227100       1.952300    
 H   -6.570200       1.651700      -1.194900    
 H    3.824800      -3.364400      -1.688800    
 H    5.535300      -2.923500      -1.185800    
 H   -8.510000      0.5055000       1.586300    


%chk=000162840-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000162840

0 1
O 2.200571 2.133091 -0.415719
O -0.265199 0.846838 1.864850
O 1.591660 -3.234654 -1.023519
O 3.084563 1.252922 1.551410
O 6.342622 -1.770238 0.896690
O -8.231474 1.021003 0.453993
N 0.563727 -0.008811 -0.148412
N 2.843129 -1.664409 0.192941
N 5.263716 0.136219 0.186647
C 0.360744 -1.440337 0.150659
C -0.892167 -2.040314 -0.525375
C 0.902949 2.380545 0.330209
C 0.000409 3.195972 -0.620824
C -2.194186 -1.316694 -0.125600
C 0.330046 1.008315 0.763708
C -3.445221 -1.969639 -0.775731
C 1.645027 -2.215965 -0.277318
C -1.407182 3.371095 0.000168
C 0.645393 4.564859 -0.937945
C -4.729032 -1.219920 -0.452681
C 4.326940 0.960303 -0.580681
C 3.180467 1.466837 0.322619
C 4.163058 -2.116499 -0.113408
C -5.463966 -1.499824 0.726320
C -5.204301 -0.183680 -1.299760
C 5.062502 2.144451 -1.255399
C 5.316620 -1.248963 0.367147
C -6.629925 -0.774620 1.056828
C -6.365482 0.552204 -0.988504
C -7.077807 0.254927 0.195292
C 4.472504 -3.272934 -0.767826
H 0.238696 -1.497033 1.252270
H -0.945272 -3.110326 -0.248901
H -0.760987 -2.019991 -1.625047
H 1.126180 2.939350 1.256204
H -0.099761 2.623074 -1.566034
H -2.307660 -1.313724 0.975999
H -2.144830 -0.252677 -0.430093
H 0.974102 0.239644 -1.052627
H -3.517352 -3.019769 -0.429815
H -3.295389 -2.007827 -1.873227
H -1.349679 3.892277 0.973446
H -2.038579 3.976425 -0.673971
H -1.914221 2.405771 0.171108
H 0.733003 5.176593 -0.019803
H 0.019877 5.124863 -1.655877
H 1.652430 4.448342 -1.373943
H 3.862690 0.341626 -1.371336
H 2.765526 -0.911285 0.887007
H 6.048752 0.624987 0.628141
H -5.124289 -2.298167 1.397467
H -4.660108 0.046406 -2.224339
H 4.349367 2.763434 -1.823666
H 5.551390 2.787007 -0.500429
H 5.833825 1.761119 -1.944013
H -7.184917 -1.011274 1.974439
H -6.735576 1.346245 -1.643972
H 3.705118 -3.958103 -1.127858
H 5.529386 -3.508355 -0.918764
H -8.656130 0.737484 1.301256


