%chk=000000185.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000185

0 1
 O   0.8092000       2.922700      0.8602000    
 O   0.6664000       2.225500      -1.294700    
 O   -3.755800     -0.7502000      -1.122800    
 O    2.494100      -1.651500       1.192900    
 O   -3.323900     -0.9417000       1.096300    
 N    1.510000     -0.2760000     -0.4074000    
 C   0.7623000      0.5695000      0.4886000    
 C  -0.6351000      2.1199999E-02  0.8021000    
 C   -1.593200     -8.7800004E-02 -0.3911000    
 C   0.7515000       1.964600     -0.1016000    
 C    2.315400      -1.318800      2.4100000E-02
 C   -2.961800     -0.6221000     -2.7400000E-02
 C    2.961000      -2.055300      -1.118900    
 H    1.330000      0.6161000       1.427100    
 H  -0.5363000     -0.9696000       1.264700    
 H   -1.101000      0.6660000       1.559100    
 H   -1.164300     -0.7581000      -1.144100    
 H   -1.740300      0.9001000     -0.8405000    
 H    1.414700     -0.1149000      -1.406600    
 H    3.749600      -2.709400     -0.7368000    
 H    2.209000      -2.659500      -1.633500    
 H    3.405400      -1.347600      -1.824700    
 H   0.7840000       3.825800      0.4780000    
 H   -4.638000      -1.113200     -0.8941000    


%chk=000000185-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000000185

0 1
O 0.266577 2.914869 0.847153
O 1.152663 2.345815 -1.222557
O -3.697700 -0.658333 -1.135623
O 2.057146 -1.858537 1.117164
O -3.237918 -1.036859 1.109140
N 1.551093 -0.245409 -0.469144
C 0.841433 0.598405 0.500362
C -0.580881 0.069338 0.860844
C -1.511934 -0.026892 -0.359419
C 0.790786 2.011155 -0.070109
C 2.148681 -1.433284 -0.075892
C -2.861413 -0.621125 -0.007279
C 2.907609 -2.184551 -1.163944
H 1.418011 0.616723 1.446328
H -0.449076 -0.923933 1.321831
H -1.016864 0.731814 1.628363
H -1.060423 -0.656659 -1.150413
H -1.693666 0.960678 -0.827001
H 1.703784 0.148142 -1.402447
H 3.942123 -2.360078 -0.822752
H 2.441862 -3.173952 -1.314090
H 2.933309 -1.652004 -2.130205
H 0.241706 3.826564 0.448069
H -4.574007 -1.056090 -0.879476


