%chk=000130489.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130489

0 1
 O   -1.412800       2.625300     -0.5814000    
 O   -5.226100      3.4400001E-02 -0.6775000    
 N   0.1491000      -1.340700      0.4472000    
 N   -3.483700     -0.6366000      0.6604000    
 N   -3.277100       1.265500     -0.6957000    
 C   -2.075800     -0.5530000       1.009900    
 C   -1.227500      -1.361900      2.9899999E-02
 C    1.003000      -2.095000     -0.4709000    
 C   -1.640100      0.9052000       1.078900    
 C    2.474800      -1.945000     -4.4900000E-02
 C   0.5391000      -3.551700     -0.4721000    
 C   -2.062700       1.673800     -0.1525000    
 C    2.951200     -0.5126000     -9.3000000E-03
 C   -4.076300      0.2023000     -0.2684000    
 C    3.507800      4.6300001E-02  -1.148700    
 C    2.822500      0.2170000       1.161800    
 C    3.947600       1.369600      -1.116100    
 C    3.262200       1.540400       1.194300    
 C    3.824700       2.116600      5.5300001E-02
 H   -1.988900     -0.9952000       2.010800    
 H   -1.333500     -0.9628000     -0.9865000    
 H   -1.643900      -2.375100      2.1299999E-02
 H   0.9027000      -1.688000      -1.485800    
 H  -0.5609000       1.016100       1.222600    
 H   -2.130700       1.393900       1.930800    
 H   0.2383000      -1.712300       1.392600    
 H    3.113500      -2.518400     -0.7303000    
 H    2.632900      -2.402400      0.9418000    
 H   -4.025100      -1.418000       1.017400    
 H  -0.3979000      -3.695300      -1.018800    
 H   0.4225000      -3.948800      0.5428000    
 H    1.282900      -4.178700     -0.9780000    
 H   -3.643000       1.828400      -1.458500    
 H    3.605400     -0.5268000      -2.066300    
 H    2.391300     -0.2218000       2.057000    
 H    4.385000       1.818600      -2.003100    
 H    3.167300       2.122000       2.106700    
 H    4.167000       3.147000      8.0600001E-02


%chk=000130489-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000130489

0 1
O -0.888695 1.337838 -2.212863
O -5.125937 0.342418 -0.546222
N 0.045574 -1.813646 0.790542
N -3.284754 0.040527 0.873730
N -2.964792 0.743480 -1.357822
C -1.823749 -0.146876 1.034563
C -1.396594 -1.595655 0.618311
C 0.865157 -2.147884 -0.397406
C -1.081439 0.928562 0.217273
C 2.370360 -1.901632 -0.089925
C 0.645186 -3.597186 -0.910287
C -1.592649 1.018132 -1.216028
C 2.723379 -0.452780 0.215664
C -3.881584 0.366263 -0.330317
C 2.567272 0.553597 -0.773819
C 3.224268 -0.073675 1.486429
C 2.896637 1.899338 -0.499109
C 3.558064 1.271669 1.767081
C 3.395147 2.264526 0.773643
H -1.574400 -0.009822 2.102325
H -1.684484 -1.750703 -0.441401
H -2.003219 -2.312141 1.210638
H 0.562078 -1.445303 -1.199234
H -0.003450 0.708320 0.206034
H -1.215256 1.923660 0.684477
H 0.296846 -2.361780 1.619323
H 2.948124 -2.254115 -0.967510
H 2.666453 -2.550702 0.759498
H -3.926884 -0.250592 1.611559
H -0.428119 -3.794238 -1.088164
H 1.009213 -4.333400 -0.167551
H 1.184486 -3.775532 -1.859692
H -3.384423 0.887242 -2.281712
H 2.175839 0.291830 -1.764703
H 3.352533 -0.837943 2.263397
H 2.760016 2.659046 -1.276524
H 3.944572 1.543605 2.756212
H 3.654022 3.307851 0.986892


