%chk=000034359.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034359

0 1
 O   -1.238700       1.131600       1.574000    
 O   -2.432400       2.007500     -0.1335000    
 O    3.085200       1.988000     -0.4050000    
 O    4.380000     -0.2057000      0.7057000    
 N   -3.334900     -0.5390000     -0.7861000    
 N   -4.337600     -0.2742000      0.1887000    
 C   -2.025100     -0.3993000     -0.1321000    
 C  -0.9186000     -0.6959000      -1.173100    
 C   0.5016000     -0.5612000     -0.6703000    
 C   -2.009000      -1.408900       1.026300    
 C   -1.937800       1.028500      0.4142000    
 C    1.141500      0.6621000     -0.7716000    
 C    1.131600      -1.664400     -0.1202000    
 C    2.451400      0.7862000     -0.3085000    
 C    2.441400      -1.540300      0.3429000    
 C    3.101300     -0.3151000      0.2488000    
 H   -1.052600      -1.707300      -1.583300    
 H   -1.036000     -2.3600001E-02  -2.035900    
 H   -2.201800      -2.428800      0.6708000    
 H   -2.734100      -1.183600       1.817800    
 H   -1.039400      -1.427900       1.535400    
 H   -3.421000      0.1206000      -1.558700    
 H   0.6395000       1.522300      -1.206500    
 H   0.6289000      -2.624400     -4.6799999E-02
 H    2.936300      -2.406600      0.7740000    
 H   -4.447800      0.7325000      0.3084000    
 H   -5.234000     -0.6045000     -0.1669000    
 H   -1.192800       2.058400       1.892100    
 H    3.980800       1.892000     -3.7200000E-02
 H    4.665500      -1.066500       1.057000    


%chk=000034359-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000034359

0 1
O -1.194597 1.118622 1.670524
O -2.337353 2.031640 -0.121400
O 3.130685 2.012371 -0.372708
O 4.482766 -0.096780 0.627446
N -3.378826 -0.523113 -0.769662
N -4.495282 -0.095735 0.017567
C -2.080582 -0.432756 -0.037623
C -0.972634 -0.702584 -1.123530
C 0.466538 -0.584828 -0.651644
C -2.052324 -1.465032 1.100218
C -1.901391 1.015383 0.476101
C 1.143612 0.659976 -0.732812
C 1.157733 -1.709264 -0.136052
C 2.472485 0.780301 -0.292164
C 2.497523 -1.598552 0.306445
C 3.147916 -0.355039 0.228929
H -1.178099 -1.720538 -1.502638
H -1.146818 0.005094 -1.959536
H -2.119576 -2.478262 0.666861
H -2.925156 -1.305085 1.754679
H -1.132105 -1.377709 1.697909
H -3.312699 -0.011590 -1.667349
H 0.647673 1.547387 -1.141218
H 0.650773 -2.678490 -0.080479
H 3.023723 -2.477156 0.700482
H -4.686943 0.914466 0.008678
H -5.310481 -0.697644 -0.104860
H -1.084910 2.081264 1.904588
H 4.056854 1.900243 -0.031078
H 4.922894 -0.904093 0.984726


