%chk=000153394.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153394

0 1
 O   0.4491000      0.2147000       2.021700    
 O    4.503400      0.7477000       1.053800    
 O   -2.616100      -2.620800      3.9099999E-02
 O  -0.5840000      -2.087300      0.6757000    
 N    1.239800      4.1200001E-02 -0.1617000    
 N   -1.728700      -1.768200      0.2770000    
 C    2.585000     -0.4048000      0.1756000    
 C    3.165600     -0.9121000      -1.139300    
 C    2.446400     -7.1400002E-02  -2.191700    
 C    1.049900      9.2000000E-02  -1.610900    
 C   0.2703000      0.2617000      0.8069000    
 C    3.333800      0.7894000      0.6868000    
 C   -1.080600      0.5975000      0.3381000    
 C   -2.031100     -0.3908000      8.7800004E-02
 C   -1.399600       1.940600      0.1455000    
 C   -3.304600     -3.4699999E-02 -0.3563000    
 C   -2.673200       2.296400     -0.2986000    
 C   -3.625500       1.308900     -0.5496000    
 H    2.550100      -1.163400      0.9635000    
 H    2.899900      -1.967400      -1.277600    
 H    4.253500     -0.8207000      -1.210600    
 H    2.932800      0.9075000      -2.280600    
 H    2.439300     -0.5391000      -3.180000    
 H   0.5768000       1.030500      -1.911900    
 H   0.4025000     -0.7434000      -1.898000    
 H    2.789300       1.749500      0.7147000    
 H  -0.6658000       2.719300      0.3373000    
 H   -4.074700     -0.7735000     -0.5632000    
 H   -2.923100       3.342600     -0.4492000    
 H   -4.616900       1.586700     -0.8955000    


%chk=000153394-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000153394

0 1
O 0.471190 0.086008 1.970823
O 4.584047 1.232893 0.442185
O -2.890420 -2.625849 0.204111
O -0.657704 -2.220806 0.000017
N 1.294347 0.111760 -0.205426
N -1.886953 -1.826423 0.082558
C 2.661654 -0.305086 0.227804
C 3.288989 -0.925981 -1.037369
C 2.571412 -0.184895 -2.197142
C 1.123342 -0.003276 -1.682495
C 0.278621 0.196495 0.716895
C 3.407331 0.936767 0.750408
C -1.104483 0.563396 0.203504
C -2.155426 -0.368548 0.006575
C -1.424542 1.937804 0.078813
C -3.477422 0.032078 -0.288754
C -2.735372 2.357566 -0.236322
C -3.765921 1.404190 -0.415959
H 2.567713 -1.012449 1.076818
H 3.076187 -2.008364 -1.073865
H 4.380302 -0.772074 -1.049698
H 3.045414 0.798553 -2.367339
H 2.598754 -0.747371 -3.144619
H 0.629128 0.891838 -2.097579
H 0.503355 -0.892057 -1.909589
H 2.803812 1.571980 1.442451
H -0.638672 2.680908 0.250150
H -4.246624 -0.734354 -0.415608
H -2.954058 3.426288 -0.330654
H -4.784401 1.727606 -0.651896