%chk=000051716.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051716

0 1
 O   -1.713900      0.8629000     -0.5301000    
 O   -3.725900     -0.5860000       1.972400    
 O   -4.504300      0.6214000      -1.365800    
 O   -2.398000      -2.565400      0.5894000    
 O    5.207400       1.389100       1.184700    
 O    6.051800     -8.1100002E-02 -0.3292000    
 N  -0.3216000      -1.017400     -0.6459000    
 C   -3.898600     -0.6674000      0.5571000    
 C   -4.096700      0.7414000     -5.2999998E-03
 C   -2.659300      -1.325900     -6.2300000E-02
 C   -2.794500       1.554000      0.1066000    
 C   -1.435100     -0.4117000      5.2400000E-02
 C   -2.898300       2.928500     -0.5444000    
 C   0.9985000     -0.6677000     -0.4277000    
 C    2.041400      -1.294700      -1.137700    
 C    1.339600      0.3261000      0.5109000    
 C    3.372800     -0.9422000     -0.9177000    
 C    2.671200      0.6787000      0.7308000    
 C    3.687700      4.4599999E-02  1.6400000E-02
 C    5.075900      0.4128000      0.2453000    
 H   -4.775100      -1.298200      0.3689000    
 H   -4.895800       1.259000      0.5370000    
 H   -2.858700      -1.544000      -1.119100    
 H   -2.534600       1.698200       1.163200    
 H   -1.195600     -0.2987000       1.117500    
 H   -1.962900       3.482700     -0.4088000    
 H   -3.056700       2.848200      -1.625200    
 H   -3.714800       3.512500     -0.1094000    
 H  -0.5155000      -1.683100      -1.386100    
 H   -4.529200     -0.1816000       2.342000    
 H   -3.194600      -3.116100      0.5011000    
 H   -3.729400      0.3676000      -1.894900    
 H    1.813700      -2.066500      -1.869900    
 H   0.5880000      0.8601000       1.084900    
 H    4.150200      -1.448000      -1.484500    
 H    2.872200       1.453900       1.465000    
 H    6.146900       1.630500       1.331200    


%chk=000051716-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000051716

0 1
O -1.763444 0.867991 -0.604541
O -3.804445 -0.811878 1.820782
O -4.453260 0.806178 -1.528661
O -2.554940 -2.718835 0.316019
O 5.291103 1.595617 0.970679
O 6.111992 -0.257212 -0.164670
N -0.337519 -1.066541 -0.661747
C -3.988049 -0.707844 0.351715
C -4.133834 0.770897 -0.094694
C -2.729194 -1.380157 -0.238715
C -2.829112 1.548106 0.190941
C -1.477345 -0.492395 -0.017001
C -2.858215 3.012022 -0.242991
C 0.984161 -0.672589 -0.435192
C 2.050001 -1.480092 -0.936145
C 1.298651 0.519377 0.283132
C 3.383261 -1.115394 -0.710483
C 2.637920 0.871268 0.512206
C 3.697962 0.062371 0.022537
C 5.117459 0.401958 0.236284
H -4.880793 -1.276885 0.028401
H -4.999022 1.237246 0.410873
H -2.870530 -1.523157 -1.325196
H -2.585232 1.459532 1.271046
H -1.296811 -0.336744 1.070289
H -1.867435 3.471787 -0.090591
H -3.128666 3.105728 -1.308306
H -3.601482 3.574332 0.350994
H -0.492786 -1.928130 -1.187313
H -4.681446 -0.769484 2.273857
H -2.713049 -2.637208 1.295856
H -3.583713 0.755989 -2.012610
H 1.819088 -2.396586 -1.492900
H 0.493398 1.178930 0.616679
H 4.205215 -1.732353 -1.088323
H 2.880745 1.785908 1.060666
H 6.267566 1.754750 1.069921


