%chk=000102880.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102880

0 1
 O   -1.657600       1.542700      9.6900001E-02
 O  -0.1589000      0.5247000      -1.330900    
 O    6.051300      -1.885700     -2.6000000E-03
 O    6.604900      0.1088000     -0.7464000    
 N   -4.000900      -1.126900     -0.8834000    
 N    5.772700     -0.6885000     -0.2514000    
 C   -2.822900     -0.5828000     -0.1835000    
 C   -5.119000     -0.6716000     -3.5700001E-02
 C   -3.105600     -0.8454000       1.302600    
 C   -4.632000     -0.9042000       1.398900    
 C   -2.784200      0.9253000     -0.5168000    
 C   -5.316800      0.8293000     -0.3349000    
 C   -4.054500       1.654600     -5.9099998E-02
 C   -3.953700      -2.579600      -1.027500    
 C  -0.4342000       1.034100     -0.2529000    
 C   0.5201000       1.201400      0.9055000    
 C    1.908600      0.7020000      0.6006000    
 C    2.232700     -0.6194000      0.8707000    
 C    2.841000       1.571400      5.3800002E-02
 C    3.517900      -1.081700      0.5877000    
 C    4.126200       1.109100     -0.2293000    
 C    4.464700     -0.2175000      3.7599999E-02
 H   -1.898500      -1.080200     -0.4932000    
 H   -6.054600      -1.202300     -0.2447000    
 H   -2.686400     -7.9499997E-02   1.962600    
 H   -2.683300      -1.809200       1.611300    
 H   -4.937600      -1.895000       1.755600    
 H   -5.024400     -0.1648000       2.104600    
 H   -2.697500       1.056900      -1.604900    
 H   -6.147000       1.225800      0.2614000    
 H   -5.599800      0.9513000      -1.388700    
 H   -4.123900       2.633300     -0.5489000    
 H   -3.987600       1.878500       1.013600    
 H   -3.869900      -3.118400     -7.8100003E-02
 H   -3.103200      -2.866800      -1.655600    
 H   -4.854900      -2.934800      -1.539300    
 H   0.1154000      0.6613000       1.770100    
 H   0.5626000       2.264300       1.172500    
 H    1.501200      -1.300500       1.296500    
 H    2.586100       2.605700     -0.1596000    
 H    3.745300      -2.121500      0.8083000    
 H    4.837200       1.810800     -0.6580000    


%chk=000102880-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000102880

0 1
O -1.202527 0.191224 0.627708
O -0.109354 -1.792824 0.053162
O 6.458479 0.257606 -1.789220
O 6.310192 2.382057 -0.972371
N -4.398523 -1.370209 -0.636293
N 5.867437 1.174453 -1.097401
C -3.323925 -1.132435 0.377811
C -5.207083 -0.110756 -0.522584
C -4.041774 -0.507048 1.622870
C -5.322044 0.165560 1.021074
C -2.346763 -0.138916 -0.301433
C -4.417638 0.998494 -1.259687
C -3.018408 1.206661 -0.618008
C -5.165813 -2.617740 -0.416026
C -0.156600 -0.718441 0.696923
C 0.930165 -0.219508 1.652048
C 2.217452 0.145501 0.918140
C 2.902135 -0.822371 0.134586
C 2.749422 1.456770 1.018719
C 4.097456 -0.492606 -0.530449
C 3.945795 1.804901 0.361125
C 4.605156 0.819813 -0.404586
H -2.791015 -2.071484 0.600658
H -6.191287 -0.254440 -1.001989
H -3.387460 0.213645 2.144359
H -4.306546 -1.295179 2.349376
H -6.239952 -0.293515 1.429464
H -5.370266 1.247314 1.239414
H -1.929691 -0.630382 -1.197640
H -4.978556 1.952327 -1.238555
H -4.310422 0.692969 -2.316703
H -2.369528 1.808503 -1.279181
H -3.120801 1.771594 0.327953
H -5.675933 -2.681548 0.575066
H -4.484047 -3.481519 -0.506459
H -5.935108 -2.712048 -1.202727
H 1.134555 -1.042511 2.362982
H 0.546169 0.642589 2.218388
H 2.480951 -1.828365 0.038889
H 2.223797 2.210112 1.615608
H 4.638970 -1.222483 -1.137767
H 4.371934 2.809232 0.428157


