%chk=000151672.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000151672

0 1
 O    3.702600      -2.050200     -5.6899998E-02
 O    1.449000       2.790900      3.0000000E-03
 N  -0.2006000      0.6769000     -0.1017000    
 N    5.373400      0.1173000      5.1700000E-02
 N   -2.549500     -0.2160000       2.253300    
 C    1.726100     -0.7859000     -8.2400002E-02
 C    1.135100      0.4661000     -6.7299999E-02
 C  -0.9797000     -0.4261000     -0.1536000    
 C   -2.399500     -0.1684000     -0.1893000    
 C   0.8907000      -1.900900     -0.1362000    
 C  -0.4890000      -1.721900     -0.1726000    
 C    3.191300     -0.9357000     -4.2300001E-02
 C    1.958800       1.677800     -9.8999999E-03
 C    4.021500      0.3042000      1.5799999E-02
 C   -3.154100     -6.7900002E-02  0.9839000    
 C    3.425300       1.504100      2.9700000E-02
 C   -3.029100     -1.5799999E-02  -1.428300    
 C   -4.524800      0.1827000      0.9181000    
 C   -4.399800      0.2348000      -1.494000    
 C   -5.147600      0.3340000     -0.3208000    
 H    1.292900      -2.909800     -0.1501000    
 H   -1.147800      -2.583500     -0.2141000    
 H    4.014700       2.415500      7.1699999E-02
 H   -2.462900     -8.8900000E-02  -2.354300    
 H   -5.120100      0.2627000       1.824300    
 H   -4.884900      0.3529000      -2.458500    
 H   -6.214800      0.5292000     -0.3721000    
 H    5.993800      0.9164000      9.1100000E-02
 H    5.754100     -0.8205000      3.7400000E-02
 H   -3.114700     -0.1392000       3.088800    
 H   -1.557600     -0.3887000       2.339700    


%chk=000151672-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000151672

0 1
O 3.915679 -1.571768 -1.310026
O 1.333339 1.994429 2.005779
N -0.199205 0.313702 0.426293
N 5.398177 0.042758 0.219494
N -2.260699 1.470780 1.487769
C 1.805733 -0.696863 -0.508524
C 1.145395 0.224921 0.350686
C -1.013210 -0.503352 -0.340167
C -2.463848 -0.338044 -0.191853
C 0.989547 -1.547240 -1.309870
C -0.401925 -1.454982 -1.230053
C 3.269753 -0.763604 -0.559597
C 1.940007 1.169046 1.242896
C 4.041053 0.182850 0.337768
C -3.041073 0.646938 0.716898
C 3.388719 1.081162 1.175337
C -3.365870 -1.151322 -0.949871
C -4.472341 0.749420 0.802420
C -4.756102 -1.034109 -0.849581
C -5.309587 -0.067659 0.040562
H 1.476412 -2.263429 -1.979152
H -1.017207 -2.110311 -1.849627
H 3.948326 1.765693 1.822793
H -2.960885 -1.898897 -1.638458
H -4.898811 1.492290 1.487541
H -5.411139 -1.675712 -1.446868
H -6.397037 0.036211 0.128718
H 6.051211 0.607285 0.756345
H 5.737667 -0.662422 -0.440319
H -2.693973 2.146880 2.114072
H -1.225303 1.361449 1.392693


