%chk=000102958.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102958

0 1
 O   -1.452300     -0.4847000      0.2402000    
 O    2.452700     -0.2833000      -1.654700    
 O   0.2738000     -8.1299998E-02   1.700600    
 O    3.800200       1.804600      0.9340000    
 O    5.610600       2.566200     -0.2019000    
 N   0.5231000      -1.499600     -0.1195000    
 N    3.980100     -0.6482000      5.3900000E-02
 C    1.897600      -1.871700      8.9599997E-02
 C    2.178400      -3.270300     -0.4376000    
 C    2.775300     -0.8408000     -0.6077000    
 C   -2.292900      0.3896000       1.001600    
 C   -3.649800      0.4431000      0.3632000    
 C  -0.1753000     -0.6355000      0.7026000    
 C    5.002100      0.2488000     -0.4329000    
 C   -3.916000       1.401000     -0.6088000    
 C   -4.628600     -0.4660000      0.7490000    
 C   -5.177300       1.450700      -1.202500    
 C   -5.889800     -0.4163000      0.1552000    
 C   -6.164100      0.5421000     -0.8205000    
 C    4.852200       1.651800      9.6299998E-02
 H    2.094500      -1.845000       1.168100    
 H    1.997200      -3.332400      -1.516800    
 H    3.221300      -3.553800     -0.2611000    
 H    1.533900      -4.008500      5.1300000E-02
 H   4.6599999E-02  -1.850600     -0.9452000    
 H    4.163600      -1.149600      0.9180000    
 H   -2.373000      2.1299999E-02   2.032100    
 H   -1.849700       1.392800       1.034900    
 H    4.963200      0.2822000      -1.525800    
 H    5.965700     -0.1480000     -0.1016000    
 H   -3.154000       2.112100     -0.9156000    
 H   -4.425200      -1.218000       1.506400    
 H   -5.390800       2.196400      -1.962700    
 H   -6.658200      -1.124100      0.4521000    
 H   -7.146000      0.5806000      -1.283000    
 H    3.724600       2.725000       1.264500    


%chk=000102958-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000102958

0 1
O -0.811988 0.426547 -1.156529
O 4.022568 -1.940455 -0.742025
O 0.084294 -0.222556 0.930513
O 3.069128 1.804363 -0.120369
O 4.846732 2.413235 1.246340
N 0.674767 -1.294099 -1.064406
N 2.917481 -0.715108 0.911694
C 1.576910 -2.283288 -0.431748
C 1.732399 -3.512817 -1.334991
C 2.962238 -1.638943 -0.116179
C -1.630301 1.482385 -0.460045
C -3.004370 0.969808 -0.089090
C -0.007297 -0.359504 -0.330474
C 4.090934 0.070799 1.261986
C -4.107987 1.185742 -0.952558
C -3.204579 0.271706 1.130615
C -5.392936 0.710214 -0.607597
C -4.488150 -0.205089 1.475442
C -5.584909 0.013640 0.608221
C 4.063669 1.535244 0.825593
H 1.109811 -2.566388 0.530694
H 2.242693 -3.245617 -2.276683
H 2.360001 -4.269123 -0.836645
H 0.746171 -3.956414 -1.556592
H 0.594066 -1.269548 -2.082322
H 1.989006 -0.458503 1.286059
H -1.061860 1.811172 0.426725
H -1.680433 2.286514 -1.210832
H 4.963678 -0.403166 0.771223
H 4.278536 0.063289 2.350690
H -3.959524 1.725977 -1.895840
H -2.347788 0.100046 1.791919
H -6.240301 0.883758 -1.280144
H -4.635343 -0.742364 2.418950
H -6.581338 -0.353738 0.878632
H 3.127723 2.762883 -0.384528


