%chk=000131057.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131057

0 1
 O   2.4000000E-02 -0.9716000       1.709600    
 O   -1.074900      -2.546400      -1.324700    
 O   -1.499400      -3.004100      0.8599000    
 N  -0.8400000      0.1056000      -1.754100    
 N    2.905100      0.4621000      -1.076100    
 N    3.555400       1.475900      0.7899000    
 C  -0.7492000      0.2044000     -0.2917000    
 C  -8.6199999E-02  -1.089200      0.2911000    
 C   -2.151300      0.4954000      0.3043000    
 C   -2.859700       1.765800     -0.2192000    
 C    1.341500      -1.306000     -0.2813000    
 C  -0.9604000      -2.311300      7.1999999E-03
 C   -2.027600       3.031200     -7.7999998E-03
 C   -4.215800       1.920200      0.4772000    
 C    2.289800     -0.1432000     -4.9600001E-02
 C    2.677400      0.4632000       1.084600    
 C    3.671300       1.448200     -0.5193000    
 H  -0.1141000       1.059700     -3.6899999E-02
 H   -2.811900     -0.3621000      0.1221000    
 H   -2.060700      0.5889000       1.393600    
 H   -3.060200       1.657600      -1.291500    
 H    1.316100      -1.560800      -1.347700    
 H    1.787800      -2.178100      0.2182000    
 H   9.0200000E-02  7.8999996E-03  -2.156700    
 H   -1.208800      0.9732000      -2.139400    
 H   -2.593200       3.921600     -0.3035000    
 H   -1.115100       3.015900     -0.6112000    
 H   -1.741700       3.147200       1.043100    
 H   -4.756500       2.789500      8.7899998E-02
 H   -4.096200       2.052200       1.558000    
 H   -4.841700       1.037200      0.3100000    
 H  -0.8686000     -0.9638000       2.092600    
 H    2.827500      0.2469000      -2.061900    
 H    2.399000      0.2508000       2.106100    
 H   -1.636000      -3.329100      -1.511100    
 H    4.284400       2.106300      -1.118400    


%chk=000131057-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000131057

0 1
O -0.094170 -1.105579 1.596749
O -0.458705 -3.062071 -1.378398
O -1.977339 -2.737337 0.340718
N -1.253092 -0.152547 -1.852682
N 3.085298 0.538597 -0.876504
N 3.346065 1.677033 1.055204
C -0.850495 0.150960 -0.462245
C -0.129817 -1.127529 0.126252
C -2.087040 0.555611 0.369878
C -2.835679 1.824755 -0.130152
C 1.347702 -1.245653 -0.327833
C -0.960948 -2.359857 -0.288538
C -1.906039 3.056310 -0.246866
C -4.024331 2.123801 0.814648
C 2.198452 -0.057528 0.041593
C 2.384319 0.664860 1.226440
C 3.753230 1.572050 -0.224113
H -0.106297 0.975096 -0.389059
H -2.801873 -0.290225 0.402147
H -1.746725 0.752103 1.404529
H -3.266978 1.619694 -1.135200
H 1.367068 -1.411247 -1.420706
H 1.755183 -2.165652 0.131697
H -0.487470 -0.272274 -2.521232
H -1.996914 0.447494 -2.216423
H -2.480398 3.951922 -0.548546
H -1.105071 2.906130 -0.993673
H -1.422289 3.274755 0.724215
H -4.614685 2.986005 0.453109
H -3.660736 2.365757 1.831853
H -4.702630 1.254074 0.895303
H -0.992267 -1.386775 1.918967
H 3.222160 0.243935 -1.842881
H 1.876848 0.510781 2.173677
H -1.076356 -3.813257 -1.594058
H 4.502315 2.197006 -0.704573


