%chk=000157820.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157820

0 1
 O   0.1887000      0.7617000     -4.6100002E-02
 O   -5.321300      0.3420000     -3.5500001E-02
 O   -1.429600      -2.970200      0.1835000    
 N   -3.855200      -1.981600      0.1164000    
 N   -4.110600       2.852700     -0.1923000    
 N    6.560100      0.7062000     -4.1400000E-02
 C   -1.793400     -0.6399000      3.7700001E-02
 C   -1.174400      0.6066000     -3.9799999E-02
 C   -3.186800     -0.7378000      3.9700001E-02
 C   0.9827000     -0.3719000      3.6600001E-02
 C  -0.9541000      -1.845100      0.1160000    
 C   -1.947500       1.765400     -0.1162000    
 C   -3.957600      0.4229000     -3.6400001E-02
 C    2.432500     -9.1799997E-02  1.6400000E-02
 C   -3.339500       1.671800     -0.1142000    
 C   0.5061000      -1.625000      0.1090000    
 C    3.318500      -1.018000     -0.5389000    
 C    2.924300       1.101100      0.5524000    
 C    4.687900     -0.7534000     -0.5579000    
 C    4.293600       1.365800      0.5333000    
 C    5.175500      0.4386000     -2.2000000E-02
 H   -1.461400       2.736400     -0.1768000    
 H    1.128800      -2.508600      0.1860000    
 H    2.976700      -1.947700     -0.9861000    
 H    2.260600       1.837600      0.9988000    
 H   -3.319000      -2.837300      0.1593000    
 H   -4.840500      -2.034700      0.3303000    
 H    5.364900      -1.481600     -0.9976000    
 H    4.661700       2.297400      0.9557000    
 H   -3.655100       3.753900     -0.2475000    
 H   -5.120300       2.794500     -0.1906000    
 H   -5.595700     -0.5470000     -0.3100000    
 H    6.914200       1.570400      0.3464000    
 H    7.199800      3.4499999E-02 -0.4444000    


%chk=000157820-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157820

0 1
O 0.208997 0.663677 0.027710
O -5.412109 0.434137 0.038811
O -1.500979 -3.147536 -0.150250
N -3.921329 -1.993213 -0.066014
N -4.109251 2.840963 0.202791
N 6.602058 0.820035 -0.023350
C -1.817578 -0.739330 -0.039640
C -1.198305 0.542123 0.034029
C -3.260140 -0.779669 -0.018501
C 1.018623 -0.484283 -0.034013
C -0.996985 -1.952396 -0.096482
C -1.906547 1.746587 0.127828
C -3.979622 0.437968 0.021751
C 2.451818 -0.153703 -0.030594
C -3.329573 1.697937 0.122509
C 0.446281 -1.739560 -0.090567
C 3.448440 -1.170370 -0.077685
C 2.890447 1.200407 0.019726
C 4.814139 -0.855360 -0.075530
C 4.254558 1.527947 0.021916
C 5.246664 0.504504 -0.025650
H -1.366731 2.694318 0.197868
H 1.072592 -2.632290 -0.137328
H 3.156554 -2.224834 -0.116222
H 2.141301 1.995667 0.056756
H -3.311078 -2.829078 -0.095029
H -4.905074 -2.039377 0.191387
H 5.558707 -1.659743 -0.112163
H 4.562871 2.579860 0.060768
H -3.689371 3.761269 0.281140
H -5.120358 2.735713 0.241616
H -5.754890 0.008700 -0.789785
H 6.912500 1.786751 0.012630
H 7.307968 0.090078 -0.056634


