%chk=000073046.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000073046

0 1
 O   -3.223200       1.304400       1.091000    
 O   -2.857300       1.236000      -1.147200    
 N   -2.519900      -1.572800     -0.4377000    
 N    2.520700     -0.2235000      0.3185000    
 N    4.565900      -1.313700      0.2976000    
 N    4.497200      0.7748000     -0.6124000    
 C  -0.4056000     -0.3505000     -0.2034000    
 C   -1.861300     -0.4779000      0.2703000    
 C   0.3174000      0.8329000      0.4565000    
 C    1.757100      0.9769000     -2.5900001E-02
 C   -2.676900      0.7659000     -3.1300001E-02
 C   -3.893700      -1.729100      1.6300000E-02
 C    3.779600     -0.2236000      7.7999998E-03
 H   0.1267000      -1.284100      1.7200001E-02
 H  -0.3766000     -0.2151000      -1.292900    
 H   -1.863900     -0.6680000       1.351300    
 H  -0.2115000       1.768100      0.2410000    
 H   0.3079000      0.6987000       1.545300    
 H    1.761200       1.136400      -1.111000    
 H    2.194900       1.858700      0.4577000    
 H   -2.009200      -2.438500     -0.2648000    
 H   -4.307100      -2.643600     -0.4226000    
 H   -4.545700     -0.9131000     -0.3099000    
 H   -3.957500      -1.835600       1.104600    
 H   -3.759300       2.100900      0.8899000    
 H    4.178700      -2.131600      0.7558000    
 H    5.552100      -1.334000      6.2300000E-02
 H    5.486500      0.6636000     -0.8069000    
 H    4.071700       1.649300     -0.8985000    


%chk=000073046-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000073046

0 1
O -3.046652 1.462370 1.279589
O -3.142513 1.378541 -1.037253
N -2.532722 -1.529366 -0.468523
N 2.438080 -0.226200 0.137641
N 4.421123 -1.430760 0.521662
N 4.604874 0.676199 -0.496586
C -0.489319 -0.146089 -0.375711
C -1.900022 -0.395393 0.218257
C 0.297849 0.989606 0.307951
C 1.757725 1.044264 -0.190986
C -2.753443 0.869948 0.033257
C -3.748858 -2.075379 0.150308
C 3.744652 -0.297383 0.039207
H 0.106545 -1.073321 -0.265356
H -0.603469 0.060812 -1.457553
H -1.805756 -0.554293 1.319463
H -0.185836 1.968281 0.115147
H 0.308069 0.832539 1.403739
H 1.744558 1.219582 -1.293245
H 2.263762 1.925493 0.272219
H -1.847358 -2.237880 -0.747905
H -4.092650 -2.951627 -0.426711
H -4.560536 -1.324442 0.117198
H -3.620563 -2.384587 1.216620
H -3.562827 2.300423 1.123283
H 3.822608 -2.123323 0.969148
H 5.242122 -1.770669 0.022254
H 5.580817 0.714418 -0.211237
H 4.208642 1.490136 -0.957276


