%chk=000083088.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083088

0 1
 O  -0.2267000      -1.248300      -1.925700    
 O  -0.9558000      1.1000000E-02   2.624100    
 O    1.991200       2.778500      -1.462000    
 O    2.005500      -2.829800     -0.7202000    
 O   -4.237700      0.5004000     -0.5453000    
 O    2.366400       2.594500      0.7713000    
 O    2.636500      -1.920300       1.264000    
 N   0.7887000      0.1613000      0.3446000    
 N   -2.221800     -0.3760000      -1.210300    
 N   -2.580400      0.2413000       1.023300    
 C  -0.3996000     -0.6873000      0.3992000    
 C   0.4500000       1.484200     -0.1798000    
 C    1.826400     -0.4626000     -0.4765000    
 C  -0.9213000     -0.8025000      -1.010800    
 C   -1.317100     -0.1215000       1.453600    
 C   -3.091700      0.1456000     -0.2634000    
 C    1.699000       2.320800     -0.2181000    
 C    2.188400      -1.789300      0.1319000    
 H  -0.1882000      -1.705900      0.7477000    
 H  -0.2592000       2.024100      0.4578000    
 H   2.9800000E-02   1.463700      -1.192400    
 H    2.764100      0.1033000     -0.3783000    
 H    1.692100     -0.5078000      -1.558000    
 H   -2.580500     -0.4510000      -2.158300    
 H   -3.204500      0.6234000       1.728400    
 H    2.798400       3.335900      -1.466300    
 H    2.262100      -3.684900     -0.3137000    


%chk=000083088-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000083088

0 1
O -0.811133 -0.674738 -2.329686
O -0.813559 1.276333 1.989955
O 2.060326 3.632614 -0.537791
O 3.110117 -2.724849 -0.151560
O -4.701168 -0.579208 0.232532
O 3.207966 1.802499 0.316388
O 1.116334 -2.522181 1.007356
N 0.820354 0.180828 -0.110921
N -2.726192 -0.741812 -1.011475
N -2.706624 0.227879 1.151994
C -0.530472 -0.312908 0.100925
C 0.926022 1.535987 -0.664251
C 1.827308 -0.768449 -0.618263
C -1.344095 -0.559502 -1.196532
C -1.316805 0.496052 1.151561
C -3.463610 -0.396455 0.141786
C 2.184637 2.275337 -0.218199
C 1.938425 -2.052238 0.183297
H -0.422626 -1.321074 0.575727
H 0.071839 2.142538 -0.320962
H 0.905144 1.559202 -1.779848
H 2.813529 -0.276899 -0.568589
H 1.649200 -1.062678 -1.679519
H -3.279961 -1.067956 -1.811086
H -3.248202 0.602975 1.937834
H 2.889211 4.115051 -0.270839
H 3.158135 -3.585549 0.346965


