%chk=000101378.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101378

0 1
 O   -3.769900      0.7616000       1.357700    
 O    3.700800      0.7891000       1.431400    
 O   -2.682100      -3.118900     -0.8631000    
 O    2.823800      -3.033400     -0.9754000    
 N   -2.648800      0.8629000     -0.6478000    
 N    2.635100      0.9321000     -0.6015000    
 N   -3.250500      -1.229800      0.2919000    
 N    3.291000      -1.173800      0.2694000    
 N   -2.620700      -1.885000     -0.8903000    
 N    2.715100      -1.802700     -0.9538000    
 C  -3.4899998E-02   2.308000     -0.6585000    
 C   -1.318800       2.834100     -8.9999996E-03
 C    1.207200       2.819000      7.8500003E-02
 C   -2.578300       2.297400     -0.6813000    
 C    2.506700       2.362900     -0.5768000    
 C   -3.258500      0.1697000      0.4015000    
 C    3.242100      0.2192000      0.4360000    
 C   -3.853700      -2.074500       1.315000    
 C    3.894500      -2.037700       1.276200    
 H  -3.5399999E-02   1.212300     -0.6497000    
 H   9.9999997E-05   2.624600      -1.707800    
 H   -1.330300       3.929600     -5.3500000E-02
 H   -1.327100       2.555400       1.052100    
 H    1.178500       2.474500       1.119600    
 H    1.191800       3.915300      0.1020000    
 H   -3.465200       2.719000     -0.1957000    
 H   -2.601700       2.598000      -1.734300    
 H    2.551500       2.711100      -1.614400    
 H    3.360300       2.796300     -4.4399999E-02
 H   -2.232200      0.3605000      -1.423200    
 H    2.259800      0.4475000      -1.408700    
 H   -3.086900      -2.733900       1.732700    
 H   -4.653300      -2.668900      0.8628000    
 H   -4.278200      -1.475000       2.124500    
 H    4.724700      -2.588800      0.8243000    
 H    3.138900      -2.736500       1.647600    
 H    4.277800      -1.456600       2.119000    


%chk=000101378-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000101378

0 1
O -3.948207 0.771342 1.422851
O 3.930934 0.866424 1.432253
O -3.137568 -3.059862 -0.995379
O 3.179955 -3.002020 -0.945747
N -2.821316 0.834060 -0.634763
N 2.793229 0.888746 -0.620301
N -3.570266 -1.238919 0.245950
N 3.585554 -1.161443 0.275786
N -3.012319 -1.789455 -0.904926
N 3.031753 -1.733313 -0.866645
C -0.028246 2.251277 -0.638273
C -1.316599 2.747378 0.054519
C 1.249351 2.775787 0.053538
C -2.621384 2.294227 -0.641817
C 2.563664 2.344408 -0.638738
C -3.462514 0.210768 0.402305
C 3.451103 0.287363 0.419306
C -4.242560 -2.063441 1.262782
C 4.278155 -1.963673 1.296817
H -0.016210 1.142500 -0.644143
H -0.032187 2.579027 -1.700463
H -1.317176 3.856188 0.081249
H -1.338204 2.405844 1.107364
H 1.276285 2.440060 1.108151
H 1.228175 3.884513 0.074716
H -3.486903 2.752749 -0.132368
H -2.626246 2.628448 -1.696421
H 2.562622 2.671010 -1.695755
H 3.419316 2.823963 -0.132058
H -2.473643 0.242084 -1.394746
H 2.453064 0.283243 -1.372976
H -3.539543 -2.812458 1.666272
H -5.093502 -2.600811 0.809845
H -4.588316 -1.386855 2.056747
H 5.135945 -2.490321 0.844222
H 3.590884 -2.721031 1.711715
H 4.616120 -1.273204 2.082132


