%chk=000149476.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149476

0 1
 O  -0.3482000     -0.6086000     -0.6181000    
 O    1.479100      0.6685000      -1.305800    
 O   -2.632400       2.748200      3.8999999E-03
 O   -3.391200      0.2254000       1.231900    
 O   0.3026000       2.952400     -0.1291000    
 O   -3.056900      -2.400800      0.7152000    
 O   -1.689500      -2.732000      -1.078300    
 O    3.045100      -1.797600      0.5876000    
 N    3.137900     -0.6683000      6.0000003E-04
 N    3.837000      0.3344000      0.3565000    
 C   -1.711000       1.719900      0.3699000    
 C   -2.414700      0.3728000      0.2024000    
 C  -0.4659000       1.812300     -0.5127000    
 C   -1.417300     -0.7742000      0.3064000    
 C   0.4123000      0.5698000     -0.3630000    
 C   -2.040300      -2.065200     -0.1161000    
 C    2.355800     -0.4556000      -1.237800    
 C    4.597700      9.8399997E-02   1.586500    
 H   -1.446500       1.900500       1.419200    
 H   -2.947700      0.3475000     -0.7562000    
 H  -0.7507000       1.954600      -1.562600    
 H   -1.013700     -0.9049000       1.318100    
 H   0.8403000      0.5307000      0.6475000    
 H   -3.413600       2.656100      0.5759000    
 H   -2.931500      0.2461000       2.088600    
 H  -0.2754000       3.730800     -0.2052000    
 H    1.811700      -1.379500      -1.466600    
 H    3.097200     -0.3316000      -2.036200    
 H   -3.480800      -3.245800      0.4534000    
 H    3.934300     -0.1079000       2.433100    
 H    5.170100      0.9996000       1.826200    
 H    5.310100     -0.7245000       1.464500    


%chk=000149476-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000149476

0 1
O -0.414548 -0.600051 -0.557903
O 1.466046 0.695912 -1.036912
O -2.657356 2.833039 0.179450
O -3.709277 0.310891 1.036113
O 0.194833 3.003448 0.205759
O -3.491685 -2.312148 0.310785
O -1.572408 -3.100179 -0.739774
O 2.774856 -0.418708 1.396530
N 3.321016 -0.305413 0.196195
N 4.586762 -0.101074 -0.082890
C -1.836604 1.655227 0.466633
C -2.578475 0.357886 0.110696
C -0.528233 1.851472 -0.320709
C -1.584488 -0.831615 0.285895
C 0.348656 0.607923 -0.136034
C -2.147841 -2.190141 -0.128027
C 2.388560 -0.415614 -0.994255
C 5.427234 -0.003148 1.133235
H -1.596938 1.615820 1.552965
H -2.918161 0.389420 -0.945809
H -0.760294 1.973257 -1.398959
H -1.306512 -0.892640 1.364684
H 0.685474 0.482212 0.913829
H -3.514228 2.728411 0.667409
H -4.169001 -0.563124 0.914684
H -0.440217 3.766589 0.204783
H 1.858474 -1.378300 -0.898324
H 3.008532 -0.350127 -1.896615
H -3.841927 -3.211453 0.068028
H 5.114153 0.854004 1.761803
H 6.466030 0.127051 0.799401
H 5.331466 -0.907328 1.767035


