%chk=000088684.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088684

0 1
 O    1.544200       2.390000       1.109600    
 O  -0.9206000      0.6053000      -1.489700    
 O   -2.523000       1.483400       1.613500    
 O   -4.581900      0.6434000       1.162800    
 N   0.8563000     -0.9321000       1.032100    
 N    4.365000       1.991000      0.4787000    
 N    1.413400       2.043000      -1.179200    
 N   -2.131800       2.457200     -0.7790000    
 C    3.195900     -0.1128000      0.9678000    
 C    2.108800      -1.077200      0.5495000    
 C    3.291200       1.102300      3.2499999E-02
 C   5.9900001E-02  -1.924400      0.5062000    
 C   0.8671000      -2.699900     -0.3289000    
 C    2.174000      -2.138700     -0.2850000    
 C    2.003200       1.919300      7.0200004E-02
 C   -1.299400      -2.191700      0.7036000    
 C   0.2917000      -3.796500      -1.000900    
 C   -1.848200      -3.284800      2.7000001E-02
 C   -1.066800      -4.076200     -0.8127000    
 C   0.1736000       2.756000      -1.372200    
 C  -0.9902000       1.800700      -1.215600    
 C   -3.403500       1.796500     -0.5910000    
 C   -3.578900       1.246300      0.8009000    
 H    4.154300     -0.6489000      0.9759000    
 H    3.010400      0.2057000       2.003000    
 H    3.512200      0.7685000     -0.9874000    
 H   0.5416000     -0.2166000       1.673700    
 H    3.048300      -2.490600     -0.8153000    
 H   -1.908500      -1.576300       1.356900    
 H   0.8892000      -4.421600      -1.658400    
 H    4.179400       2.319400       1.425700    
 H    4.401500       2.817600     -0.1163000    
 H    1.841200       1.604600      -1.989200    
 H   0.1088000       3.579700     -0.6545000    
 H   0.1654000       3.159600      -2.388900    
 H   -2.901400      -3.519700      0.1584000    
 H   -1.516100      -4.920800      -1.328400    
 H   -2.087300       3.451300     -0.5749000    
 H   -3.487900      0.9713000      -1.304200    
 H   -4.185300       2.538500     -0.7753000    
 H   -2.659900       1.113000       2.511400    


%chk=000088684-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000088684

0 1
O 1.308140 3.136541 0.010978
O -2.267835 1.014472 -1.882597
O -1.672763 0.990586 2.042626
O -3.310920 2.442435 2.806193
N 0.127110 -0.898451 0.640329
N 3.717469 2.249165 1.175357
N 1.194657 1.290154 -1.395129
N -1.395068 2.510513 -0.314799
C 2.250793 0.254207 1.448603
C 1.526635 -0.883505 0.778649
C 2.883220 1.287997 0.444365
C -0.259724 -2.031143 -0.086962
C 0.939302 -2.766523 -0.408259
C 2.050230 -2.016949 0.142067
C 1.744552 1.983010 -0.345304
C -1.542289 -2.459789 -0.495923
C 0.827448 -3.980049 -1.139801
C -1.621195 -3.663673 -1.223898
C -0.450279 -4.418149 -1.537397
C 0.055161 1.807936 -2.178891
C -1.308901 1.722397 -1.450734
C -2.635288 2.589879 0.443592
C -2.593868 2.048159 1.866859
H 3.097296 -0.122647 2.047191
H 1.581866 0.804665 2.138565
H 3.525436 0.718625 -0.252720
H -0.508837 -0.170483 0.989246
H 3.104516 -2.290400 0.106517
H -2.439390 -1.870821 -0.278507
H 1.719798 -4.564436 -1.391048
H 3.144228 2.979681 1.618496
H 4.448135 2.674129 0.593590
H 1.477096 0.314701 -1.534944
H 0.261990 2.863895 -2.432890
H -0.032656 1.221641 -3.105444
H -2.598815 -4.023931 -1.562956
H -0.553607 -5.350873 -2.103321
H -0.549783 3.045428 -0.039061
H -3.390404 2.001488 -0.118737
H -3.006283 3.627675 0.515969
H -1.741273 0.667247 2.982529


