%chk=000157281.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157281

0 1
 O    3.297000       1.113200      0.2382000    
 O   -2.801400      0.5356000       1.036800    
 N   -1.202200     -0.9482000      0.2445000    
 N   -3.385700      -1.133400     -0.4676000    
 C    1.068200      9.9399999E-02  6.2799998E-02
 C  -8.5900001E-02 -0.4065000      0.9712000    
 C    1.634000      -1.051700     -0.8373000    
 C   0.5767000       1.221800     -0.9140000    
 C    2.184400      0.6499000      0.9926000    
 C    2.169700      -2.251900     -0.1059000    
 C  -1.3800000E-02   2.443200     -0.2645000    
 C   -2.494000     -0.4268000      0.3349000    
 C    3.412500      -2.724500     -0.2548000    
 C   0.4305000       3.688000     -0.4717000    
 C   -4.789900     -0.8082000     -0.5652000    
 H   0.2650000      -1.203400       1.636000    
 H  -0.4310000      0.3949000       1.634000    
 H   0.8411000      -1.409800      -1.507200    
 H    2.407300     -0.6500000      -1.505600    
 H  -0.1890000      0.8086000      -1.583900    
 H    1.406500       1.519700      -1.569100    
 H    1.819700       1.489700       1.593500    
 H    2.539600     -0.1106000       1.697000    
 H   -1.060500      -1.788600     -0.3068000    
 H    1.493000      -2.793800      0.5484000    
 H  -0.8739000       2.313900      0.3842000    
 H    3.787900      0.3357000     -7.5900003E-02
 H    3.732100      -3.609000      0.2851000    
 H    4.128600      -2.241700     -0.9104000    
 H  -4.9899999E-02   4.530600      1.3600000E-02
 H    1.274800       3.888600      -1.121700    
 H   -3.043100      -1.937400     -0.9842000    
 H   -5.110500     -0.9718000      -1.596700    
 H   -5.342600      -1.476200      9.9900000E-02
 H   -4.970700      0.2303000     -0.2775000    


%chk=000157281-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157281

0 1
O 3.419234 0.914139 0.246989
O -2.758491 0.665373 0.810950
N -1.246864 -1.032750 0.235903
N -3.495924 -1.168261 -0.445457
C 1.051718 0.068259 0.017158
C -0.108431 -0.427323 0.938497
C 1.632825 -1.110638 -0.837666
C 0.574165 1.175474 -0.983202
C 2.157670 0.642481 0.950601
C 2.368496 -2.177228 -0.051465
C -0.119461 2.369164 -0.354211
C -2.516402 -0.443785 0.236074
C 3.637160 -2.592318 -0.306301
C 0.397767 3.624413 -0.335212
C -4.877712 -0.687308 -0.529242
H 0.293723 -1.153364 1.674800
H -0.516296 0.421940 1.513589
H 0.789233 -1.572985 -1.392991
H 2.307380 -0.691752 -1.607754
H -0.112393 0.700396 -1.715162
H 1.468189 1.518804 -1.538240
H 1.837528 1.619888 1.348259
H 2.332717 -0.050268 1.801943
H -1.121007 -1.955417 -0.181279
H 1.823545 -2.646681 0.782792
H -1.107181 2.183456 0.094306
H 3.885636 0.049125 0.112750
H 4.120904 -3.373552 0.290587
H 4.221055 -2.176964 -1.139052
H -0.147105 4.460913 0.118383
H 1.379973 3.850152 -0.771069
H -3.253611 -2.042838 -0.911431
H -5.182579 -0.503061 -1.576779
H -5.585787 -1.401980 -0.068665
H -4.925174 0.264091 0.024297


