%chk=000161625.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161625

0 1
 O    3.044900      -1.037000      0.3438000    
 O   -1.258100       1.687300     -0.1076000    
 O   -3.417600     -0.9753000      -1.211000    
 O   -5.373100     -0.1641000     -0.3950000    
 N   -1.988000     -0.2929000      0.8668000    
 C    2.764500      0.1818000     -0.1028000    
 C   -3.391800      4.1800000E-02  0.9566000    
 C    1.373400      0.6677000     -9.2299998E-02
 C   -1.038900      0.5660000      0.3388000    
 C   0.3264000     -3.1800002E-02  0.3693000    
 C    3.823600      0.8773000     -0.5394000    
 C    4.915900     -2.3000001E-03 -0.3496000    
 C    4.390200      -1.153200      0.1897000    
 C   -4.171400     -0.3651000     -0.2672000    
 H   -3.495500       1.122400       1.092100    
 H   -3.797100     -0.4892000       1.822300    
 H   -1.708200      -1.211400       1.198800    
 H    1.225400       1.669400     -0.4895000    
 H   0.4445000      -1.031800      0.7737000    
 H    3.851500       1.878600     -0.9453000    
 H    5.956300      0.1794000     -0.5775000    
 H    4.816900      -2.094800      0.5034000    
 H   -3.947500      -1.230400      -1.996100    


%chk=000161625-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000161625

0 1
O 3.078104 -1.041165 -0.287925
O -1.107093 1.940508 0.579337
O -3.934299 -1.922738 -0.233292
O -5.697305 -0.463951 0.185218
N -2.040007 -0.129279 0.099115
C 2.868896 0.321676 0.058878
C -3.393652 0.387410 0.273618
C 1.522958 0.804173 0.218965
C -0.947795 0.712123 0.271224
C 0.376536 0.070086 0.070990
C 4.112816 0.946713 0.178742
C 5.127098 -0.039635 -0.097029
C 4.465172 -1.227047 -0.374383
C -4.471112 -0.662356 0.082877
H -3.596388 1.218406 -0.431420
H -3.520135 0.832565 1.280562
H -1.929803 -1.115374 -0.143287
H 1.411976 1.863569 0.485973
H 0.423932 -0.993013 -0.195172
H 4.270566 1.992700 0.435508
H 6.204780 0.109180 -0.091197
H 4.791016 -2.230517 -0.634426
H -4.669962 -2.581634 -0.350876


