%chk=000166753.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000166753

0 1
 O    1.602200     -0.1756000     -0.9954000    
 O    3.814800       1.619000      0.1253000    
 O    2.321500      -2.855200     -0.6005000    
 O   -1.169000       2.816900     -0.3790000    
 O   -4.354100     -0.4442000      0.2277000    
 N  -0.4497000      0.6043000     -0.1853000    
 N   -2.747000       1.180500     -7.5400002E-02
 C    3.034700      0.5907000      0.7314000    
 C   0.9442000      0.9090000     -0.3253000    
 C    1.641800       1.106000       1.010700    
 C    2.792900     -0.5327000     -0.2671000    
 C    2.546100      -1.878200      0.4029000    
 C  -0.8231000     -0.7217000     -8.0000004E-03
 C   -1.427400       1.621400     -0.2250000    
 C   -2.086700      -1.140200      0.1350000    
 C   -3.174300     -0.1265000      0.1033000    
 C   -2.467000      -2.573500      0.3248000    
 H    3.564100      0.2619000       1.630500    
 H    1.068400       1.801100     -0.9506000    
 H    1.173600      0.4977000       1.794000    
 H    1.606800       2.151900       1.331400    
 H    3.602000     -0.6190000      -1.000800    
 H    1.694400      -1.867800       1.086700    
 H    3.431800      -2.178400      0.9730000    
 H  -4.2199999E-02  -1.464200      6.8999999E-03
 H    3.897000       2.340800      0.7718000    
 H   -3.468500       1.895600     -0.1011000    
 H    2.181000      -3.703900     -0.1472000    
 H   -2.992400      -2.706900       1.276100    
 H   -1.592100      -3.232200      0.3334000    
 H   -3.124500      -2.905100     -0.4854000    


%chk=000166753-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000166753

0 1
O 1.683716 -0.186739 -1.076090
O 4.074024 1.450152 -0.231445
O 1.931699 -2.844958 -0.107714
O -0.956178 2.704586 0.384341
O -4.334146 -0.525766 0.719861
N -0.439043 0.476145 -0.143286
N -2.618405 1.048446 0.536573
C 3.137732 0.693375 0.608133
C 0.960846 0.926702 -0.488889
C 1.763083 1.390448 0.759632
C 2.798821 -0.587847 -0.177673
C 2.410335 -1.751757 0.746209
C -0.849719 -0.850839 -0.297800
C -1.319801 1.496534 0.266495
C -2.134495 -1.269267 -0.026360
C -3.124566 -0.285146 0.431649
C -2.584104 -2.699950 -0.196149
H 3.594990 0.473845 1.595792
H 0.863419 1.722527 -1.245302
H 1.256547 1.054180 1.681252
H 1.834639 2.488319 0.800961
H 3.623324 -0.885689 -0.844092
H 1.621621 -1.441066 1.465413
H 3.313997 -2.053428 1.318179
H -0.070733 -1.529539 -0.660103
H 4.180059 2.363542 0.136474
H -3.284103 1.766658 0.839590
H 1.809895 -3.661525 0.438420
H -2.967146 -3.109034 0.756774
H -1.758079 -3.337563 -0.554446
H -3.418931 -2.763843 -0.917599


