%chk=000176706.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176706

0 1
 O    4.241500      0.3914000      5.7500001E-02
 O    3.196000      -1.492200     -0.6461000    
 N   0.7151000     -0.4784000     -0.2804000    
 N   -2.749800     -8.8500001E-02  3.3199999E-02
 N   -2.444700       1.207900     -0.1474000    
 C  -0.5925000     -0.1021000     -0.1888000    
 C   -1.666700     -0.9171000      1.6300000E-02
 C    1.835000      0.3467000      0.1136000    
 C   -1.116100       1.190600     -0.2832000    
 C   -1.776700      -2.377900      0.1969000    
 C    1.746300      0.6897000       1.591100    
 C  -0.3950000       2.457400     -0.5033000    
 C   -4.130900     -0.4680000      0.2217000    
 C    3.138400     -0.3594000     -0.1812000    
 H    1.868000       1.252800     -0.4969000    
 H   0.9298000      -1.472200     -0.3360000    
 H   -2.299600      -2.618700       1.128400    
 H   -2.326100      -2.829900     -0.6352000    
 H  -0.7929000      -2.855000      0.2423000    
 H    2.559300       1.362600       1.885700    
 H   0.8063000       1.171800       1.871300    
 H    1.839500     -0.2137000       2.206200    
 H   0.2106000       2.742400      0.3598000    
 H   0.2385000       2.400900      -1.393900    
 H   -1.097600       3.281300     -0.6773000    
 H   -4.772400      0.4068000      8.6499996E-02
 H   -4.387800      -1.229300     -0.5189000    
 H   -4.244400     -0.8587000       1.235900    
 H    5.067000     -8.7600000E-02 -0.1694000    


%chk=000176706-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000176706

0 1
O 4.281938 0.385663 0.097931
O 3.239478 -1.562630 -0.615865
N 0.764985 -0.362865 -0.489373
N -2.792935 -0.071707 0.067866
N -2.514788 1.272370 -0.170962
C -0.582000 0.003280 -0.279991
C -1.651813 -0.867625 0.033532
C 1.867920 0.339285 0.176358
C -1.162840 1.314406 -0.398356
C -1.658284 -2.350349 0.263820
C 1.730993 0.426364 1.729430
C -0.495451 2.615830 -0.745032
C -4.169320 -0.476505 0.336984
C 3.156623 -0.395108 -0.171473
H 1.964484 1.372775 -0.208915
H 0.970288 -1.334826 -0.733902
H -2.347669 -2.637803 1.079171
H -1.953969 -2.924923 -0.636527
H -0.645933 -2.688034 0.551473
H 2.551348 1.024033 2.162630
H 0.767796 0.906886 1.973358
H 1.738167 -0.581834 2.181071
H 0.169201 2.979858 0.063497
H 0.118393 2.515235 -1.659781
H -1.262664 3.387976 -0.921592
H -4.801525 0.412736 0.197478
H -4.496614 -1.268055 -0.361188
H -4.292253 -0.844191 1.373185
H 5.104545 -0.136640 -0.106427


