%chk=000169196.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000169196

1 1
 O   -2.164300     -4.7499999E-02  -1.895200    
 O  -0.1632000      0.9448000      0.4676000    
 O   0.2481000      -1.747900      0.3942000    
 O   0.6566000       1.164800      -1.676500    
 O    2.246800      -1.281400       1.934200    
 O    1.549500      -2.815200      -1.175200    
 N   -3.814400      0.4236000      5.7999999E-03
 C   -2.331300      3.4100000E-02 -0.4772000    
 C   -1.504200       1.233700      5.4400001E-02
 C   -3.695000       1.741300      0.7758000    
 C   -2.268500       1.740400       1.266500    
 C   -4.216500     -0.7415000      0.9333000    
 C   -2.094900      -1.342800      0.1156000    
 C   -4.786100      0.5583000      -1.148300    
 C   -3.124500      -1.745900      0.8700000    
 C  -0.9411000      -2.222200     -0.2445000    
 C    2.181200       1.086300      0.2211000    
 C   0.8245000       1.050800     -0.4695000    
 C    3.094500     -0.1421000     -6.5200001E-02
 C    2.607800      -1.485200      0.5689000    
 C    2.851200       2.418700     -0.1406000    
 C    1.430000      -2.107000     -0.1822000    
 C    3.465400     -0.2805000      -1.550900    
 C    3.737000      -2.526500      0.6224000    
 C    1.977200       3.585900      0.3017000    
 C    4.234300       2.502900      0.4937000    
 H   -1.480900       2.032600     -0.7012000    
 H   -4.449000       1.779700       1.567200    
 H   -3.864800       2.560500      6.7599997E-02
 H   -1.934400       2.737000       1.572200    
 H   -2.132000       1.078400       2.130000    
 H   -5.164500      -1.158100      0.5786000    
 H   -4.343300     -0.3640000       1.952500    
 H   -5.759900      0.8413000     -0.7381000    
 H   -4.418100       1.333900      -1.825800    
 H   -4.854600     -0.4037000      -1.664000    
 H   -3.191200      -2.714000       1.346700    
 H   -2.673700     -0.8089000      -2.221000    
 H   -1.113000      -3.250700      9.3800001E-02
 H  -0.8239000      -2.242700      -1.334100    
 H    1.999900       1.119800       1.304100    
 H    4.035000      4.8200000E-02  0.4653000    
 H    2.968900       2.510100      -1.227500    
 H    3.923300      0.6327000      -1.941100    
 H    4.198200      -1.077600      -1.705900    
 H    2.594200     -0.5070000      -2.171700    
 H    4.596500      -2.144800       1.185500    
 H    3.401900      -3.430000       1.147000    
 H    4.079900      -2.834800     -0.3695000    
 H    1.765300       3.543600       1.375800    
 H    2.479200       4.539400      0.1025000    
 H    1.022800       3.617000     -0.2329000    
 H    4.211800       2.242900       1.557500    
 H    4.627500       3.523500      0.4175000    
 H    4.964200       1.864900     -1.3400000E-02
 H    1.413500     -0.7819000       1.958400    


%chk=000169196-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000169196

1 1
O -2.541713 0.297410 -2.018067
O -0.246504 1.080484 0.486139
O 0.269074 -1.774955 0.182290
O 0.636784 0.739074 -1.641954
O 2.188270 -1.478827 1.941362
O 1.621794 -2.823592 -1.403934
N -3.861312 0.423406 0.120300
C -2.386357 0.167420 -0.616257
C -1.538348 1.406553 -0.127534
C -3.822590 1.887304 0.570688
C -2.360562 2.136008 0.951279
C -3.890564 -0.581550 1.287268
C -2.046736 -1.227817 -0.108105
C -5.016295 0.160560 -0.823338
C -2.863256 -1.617856 0.902744
C -0.911977 -2.036144 -0.681149
C 2.179441 0.941773 0.309974
C 0.851111 0.872768 -0.419820
C 3.157507 -0.245040 -0.008218
C 2.653263 -1.643275 0.553341
C 2.819135 2.354716 -0.016398
C 1.525256 -2.182307 -0.345009
C 3.625458 -0.303009 -1.480030
C 3.795997 -2.670499 0.620043
C 1.860242 3.509781 0.363641
C 4.171733 2.536042 0.711385
H -1.370905 2.016601 -1.035089
H -4.543760 2.040971 1.389277
H -4.126207 2.497007 -0.297193
H -2.127830 3.211662 0.979909
H -2.113084 1.718485 1.942963
H -4.911771 -0.982910 1.402814
H -3.617359 -0.058499 2.221089
H -5.952657 0.445536 -0.317407
H -4.882139 0.759676 -1.734753
H -5.046142 -0.910601 -1.078763
H -2.790118 -2.571240 1.432344
H -2.694231 -0.571865 -2.471310
H -1.132981 -3.117276 -0.658043
H -0.654024 -1.746361 -1.717138
H 1.970879 0.928943 1.395599
H 4.039864 -0.048154 0.630751
H 2.991100 2.399255 -1.109615
H 4.161866 0.622704 -1.751201
H 4.326213 -1.139065 -1.639197
H 2.785527 -0.419797 -2.183704
H 4.624000 -2.252920 1.216831
H 3.441683 -3.585983 1.121416
H 4.162663 -2.939487 -0.382154
H 1.606132 3.479684 1.440014
H 2.343157 4.481151 0.156779
H 0.918081 3.484910 -0.215364
H 4.064483 2.381776 1.801736
H 4.543821 3.564098 0.552728
H 4.951295 1.848375 0.341088
H 1.242492 -1.177906 1.930851


