%chk=000161173.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161173

0 1
 O   0.1344000     -0.1266000       1.665700    
 O   -2.097900     -0.5396000      -1.621000    
 O    4.409100     -0.4549000      -1.749500    
 O    4.521400       1.763300      -1.293300    
 O   -2.945800       1.980100      0.7655000    
 O   -4.704400       2.900300     -0.3338000    
 N  -0.2380000      -1.726900      2.3700001E-02
 N    5.069200       1.154100       1.338500    
 N   -3.562300     -0.4894000      0.1785000    
 C    2.840100      0.1963000       1.007500    
 C    1.967800     -0.7924000      0.2310000    
 C    4.303300      0.1848000      0.5510000    
 C   -1.639100      -1.946300      0.2984000    
 C   0.5365000     -0.8255000      0.7394000    
 C   -2.054300      -3.368000     -4.7100000E-02
 C   -2.441100     -0.9337000     -0.5084000    
 C    4.431300      0.6065000     -0.9016000    
 C   -4.461500      0.5056000     -0.3576000    
 C   -4.068800       1.912400      1.3400000E-02
 H    2.417100       1.204000      0.8939000    
 H    2.790100     -4.3000001E-02   2.078000    
 H    2.384100      -1.803500      0.3116000    
 H    1.929900     -0.5209000     -0.8298000    
 H    4.750200     -0.8067000      0.6837000    
 H   -1.803900      -1.774100       1.368700    
 H   0.1750000      -2.208400     -0.7704000    
 H   -1.905300      -3.578000      -1.112500    
 H   -1.465700      -4.095800      0.5213000    
 H   -3.113700      -3.531700      0.1768000    
 H    6.056700       1.089000       1.093200    
 H    5.007400      0.9150000       2.327500    
 H   -3.763800     -0.8589000       1.102900    
 H   -5.453500      0.3001000      5.4200001E-02
 H   -4.481300      0.4252000      -1.448500    
 H    4.478400     -0.1752000      -2.687100    
 H   -2.710900       2.905000      0.9926000    


%chk=000161173-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000161173

0 1
O -0.279897 -1.408889 2.085613
O -3.222850 -1.037122 -1.397152
O 4.035751 -0.720860 -1.208517
O 4.523267 1.517121 -1.550572
O -0.935025 1.774751 0.181616
O -2.512959 3.313618 0.921320
N -0.336319 -2.249296 -0.075837
N 3.175589 2.312517 0.688613
N -2.577478 -0.356754 0.744181
C 1.862160 0.225357 0.553459
C 1.788682 -1.310083 0.764975
C 3.282552 0.860960 0.488712
C -1.788123 -2.551272 -0.039815
C 0.326513 -1.680283 0.991054
C -2.139540 -3.647116 -1.052396
C -2.604040 -1.248939 -0.310705
C 3.996904 0.630014 -0.843196
C -3.186424 0.962611 0.633914
C -2.212130 2.141438 0.610265
H 1.298661 0.519693 -0.349931
H 1.350775 0.705824 1.406975
H 2.355121 -1.588145 1.672958
H 2.230190 -1.846671 -0.091480
H 3.917424 0.351655 1.255840
H -2.007578 -2.882037 0.992800
H 0.155608 -2.379961 -0.962475
H -1.979704 -3.292793 -2.085828
H -1.535083 -4.552572 -0.868513
H -3.206465 -3.910783 -0.968298
H 3.803351 2.871215 0.103278
H 3.117008 2.613348 1.662386
H -1.960485 -0.585998 1.542416
H -3.897819 1.156060 1.456459
H -3.760037 0.977261 -0.314287
H 4.541912 -0.808098 -2.062101
H -0.328813 2.566429 0.180668


