%chk=000083389.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083389

0 1
 O    3.422400     -0.5887000      1.4000000E-03
 O    2.752800       1.502000     -3.9999999E-04
 N   0.1012000      0.7065000     -3.0000001E-04
 N  -0.7867000      -1.329200     -1.1000000E-03
 N    2.486300      0.2641000      3.0000001E-04
 C   -2.374800      0.5954000      5.0000002E-04
 C   -1.005500     -5.8600001E-02 -5.0000002E-04
 C   -3.167000      0.2405000       1.261200    
 C   -3.168400      0.2419000      -1.259600    
 C    1.156300     -0.1619000     -6.9999998E-04
 C   0.5833000      -1.412000     -7.9999998E-04
 H   -2.238300       1.685600      1.1000000E-03
 H   -3.362300     -0.8362000       1.320100    
 H   -4.130300      0.7612000       1.275600    
 H   -2.614200      0.5272000       2.162700    
 H   -2.616600      0.5296000      -2.161400    
 H   -4.131600      0.7628000      -1.272400    
 H   -3.363700     -0.8347000      -1.319400    
 H   0.1526000       1.717500      1.9999999E-04
 H    1.082400      -2.370700     -6.9999998E-04


%chk=000083389-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000083389

0 1
O 3.477204 -0.648630 -0.000722
O 2.746807 1.536857 0.000557
N 0.139541 0.736387 0.000286
N -0.790684 -1.323122 -0.000502
N 2.543978 0.245810 -0.000390
C -2.414607 0.651687 0.000742
C -1.046200 0.021665 0.000180
C -3.193273 0.240854 1.280362
C -3.193899 0.241767 -1.278785
C 1.185811 -0.189026 -0.000338
C 0.590342 -1.460461 -0.000810
H -2.285664 1.753140 0.001108
H -3.299406 -0.856817 1.319714
H -4.200730 0.693631 1.271237
H -2.672563 0.569957 2.197208
H -2.673633 0.571511 -2.195652
H -4.201352 0.694538 -1.268852
H -3.300054 -0.855877 -1.318865
H 0.284613 1.748060 0.000671
H 1.081668 -2.429630 -0.001347


