%chk=000107777.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000107777

0 1
 O   -3.153400      -1.320100      0.5098000    
 O   -2.130200       2.629900      2.8600000E-02
 O    2.475800      0.8402000      -1.526000    
 O    5.811800       1.295300       1.192500    
 N   0.3166000       1.983100     -0.5235000    
 N    5.596900      -1.442500      0.3391000    
 C   -4.172800     -0.3468000      0.2243000    
 C   -3.787200       1.046600      0.7330000    
 C   -1.461200      0.3692000      1.9800000E-02
 C   -2.434400       1.458100      0.2169000    
 C   -1.873000     -0.9520000      0.1991000    
 C   -4.493400     -0.3537000      -1.280100    
 C   -5.421100     -0.8202000      0.9846000    
 C  -0.1344000      0.6588000     -0.3114000    
 C   0.7848000     -0.3814000     -0.4495000    
 C  -0.9439000      -1.986900      7.5499997E-02
 C    3.274800      -1.089400     -0.3136000    
 C   0.3821000      -1.701800     -0.2521000    
 C    2.176100     -0.1311000     -0.8078000    
 C    4.635100     -0.4146000     -7.5400002E-02
 C    4.551000      0.6594000       1.016000    
 H   -3.721200       1.061800       1.828000    
 H   -4.529100       1.789800      0.4197000    
 H   -4.754100      -1.364500      -1.614700    
 H   -5.328900      0.3147000      -1.513500    
 H   -3.634900     -4.4199999E-02  -1.885100    
 H   -5.220900     -0.8860000       2.060400    
 H   -6.269700     -0.1455000      0.8304000    
 H   -5.715100      -1.826900      0.6650000    
 H   -1.249300      -3.020300      0.2181000    
 H    3.373500      -1.878300      -1.069800    
 H    2.946700      -1.554700      0.6245000    
 H    1.067500      -2.536500     -0.3689000    
 H    5.002500      4.1900001E-02  -1.002200    
 H    1.290900       2.177200     -0.7078000    
 H  -0.3184000       2.762300     -0.4243000    
 H    3.827100       1.435300      0.7484000    
 H    4.247000      0.2256000       1.975600    
 H    6.512800      -1.016500      0.4751000    
 H    5.706400      -2.128900     -0.4064000    
 H    5.699600       1.962000       1.891500    


%chk=000107777-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000107777

0 1
O -3.274061 -1.294702 0.523966
O -2.534853 2.755294 -0.253696
O 2.585796 1.408563 -0.432693
O 6.622099 0.760865 0.692480
N 0.065572 2.170648 -0.435288
N 5.590232 -1.637600 -0.215615
C -4.406127 -0.404011 0.036901
C -4.102665 1.043347 0.474068
C -1.650283 0.519106 0.066524
C -2.716165 1.519853 0.042458
C -1.972236 -0.842679 0.362314
C -4.487213 -0.552163 -1.495507
C -5.645079 -0.974441 0.735458
C -0.254545 0.884751 -0.127501
C 0.782381 -0.125784 0.027133
C -0.962839 -1.822192 0.519728
C 3.262240 -0.890254 0.014208
C 0.377396 -1.449916 0.356755
C 2.207230 0.211487 -0.144930
C 4.724919 -0.434395 -0.186705
C 5.200520 0.456429 0.968423
H -4.156829 1.112207 1.579598
H -4.854023 1.738299 0.061365
H -4.625435 -1.612411 -1.766878
H -5.346421 0.023697 -1.883858
H -3.574971 -0.179593 -1.992767
H -5.531705 -0.927296 1.832035
H -6.543173 -0.399561 0.447780
H -5.797841 -2.028631 0.447341
H -1.253528 -2.849607 0.750566
H 3.046139 -1.693606 -0.719902
H 3.177704 -1.370013 1.009415
H 1.143281 -2.221654 0.478979
H 4.784197 0.181256 -1.112719
H 1.071658 2.377857 -0.545555
H -0.710255 2.845222 -0.517556
H 4.595732 1.380686 0.993872
H 5.107113 -0.101320 1.924985
H 6.577825 -1.378943 -0.097240
H 5.448363 -2.221376 -1.048049
H 6.962250 1.390981 1.373909


