%chk=000131192.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131192

0 1
 O    7.985800      0.5626000      -1.781700    
 O    4.661400       1.906800       1.760800    
 O    5.905600      0.7048000      -2.677600    
 O    5.848300      -4.445500     -7.2099999E-02
 O    7.010300      -3.390900       1.566400    
 O   -5.598000      -3.073200      0.1218000    
 N    4.733200      0.7727000     -0.2610000    
 N   -2.275300      0.7889000      0.2528000    
 N   -7.753800      0.2583000     -0.3682000    
 N   -5.812600       1.646000     -0.2311000    
 N   -7.654700      -2.112400     -0.1923000    
 N   -9.679900     -0.9778000     -0.5148000    
 C    6.151300      0.5167000     -0.2618000    
 C    6.516600     -0.7950000      0.4435000    
 C    5.949600      -2.073300     -0.1871000    
 C  -0.1348000       1.913900      0.3780000    
 C   -1.611100       2.074500      0.2433000    
 C    2.627300       1.615900      0.6312000    
 C    4.098200       1.456900      0.7664000    
 C    6.630000      0.5931000      -1.697000    
 C   0.4522000       1.900800       1.643500    
 C   0.6592000       1.778100     -0.7606000    
 C    1.833200       1.751800       1.769900    
 C    2.040300       1.629100     -0.6341000    
 C   -3.641800      0.6316000      9.9900000E-02
 C   -5.604200     -0.7422000     -4.0300000E-02
 C   -4.223600     -0.6290000      0.1175000    
 C    6.328300      -3.338200      0.5525000    
 C   -6.370300      0.4116000     -0.2125000    
 C   -4.471000       1.725900     -7.5400002E-02
 C   -6.282000      -2.065900     -3.0300001E-02
 C   -8.317600     -0.9965000     -0.3494000    
 H    6.632700       1.346200      0.2721000    
 H    6.179500     -0.7425000       1.487300    
 H    7.610000     -0.8856000      0.4851000    
 H    4.855600      -2.020000     -0.2083000    
 H    6.317400      -2.168500      -1.214800    
 H    4.190500      0.3584000      -1.011700    
 H   -1.983900       2.703200       1.062300    
 H   -1.826600       2.611700     -0.6895000    
 H  -0.1558000       2.003000       2.538500    
 H   0.2143000       1.791800      -1.752200    
 H    2.271200       1.739000       2.764500    
 H    2.624500       1.557500      -1.546600    
 H   -1.719300     -4.9300000E-02  0.3858000    
 H   -3.604100      -1.511700      0.2529000    
 H   -4.101200       2.745600     -9.9900000E-02
 H   -8.309400       1.095300     -0.4932000    
 H    8.295400      0.6284000      -2.710200    
 H    6.106700      -5.269000      0.3943000    
 H   -10.18640     -0.1076000     -0.6362000    
 H   -10.21960      -1.836400     -0.5205000    


%chk=000131192-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000131192

0 1
O 8.045604 0.590905 -2.033930
O 4.815495 1.521232 1.786218
O 5.882575 0.573819 -2.879149
O 6.102618 -4.354260 0.002209
O 7.354230 -3.184759 1.570804
O -5.882411 -3.141969 -0.073854
N 4.782272 0.762841 -0.401310
N -2.399954 0.711328 0.548216
N -7.856876 0.427460 -0.582330
N -5.916729 1.719536 -0.194802
N -7.873409 -1.985411 -0.522110
N -9.836100 -0.808622 -0.965710
C 6.241727 0.609896 -0.433615
C 6.748252 -0.653337 0.327779
C 6.174496 -1.963644 -0.237289
C -0.175207 1.765785 0.716565
C -1.682905 1.980851 0.724304
C 2.653163 1.392780 0.676207
C 4.150497 1.233814 0.738125
C 6.663486 0.595039 -1.898518
C 0.637419 2.290236 1.751371
C 0.443265 1.043403 -0.336876
C 2.034354 2.106610 1.732275
C 1.840090 0.856246 -0.357347
C -3.765086 0.619766 0.283238
C -5.773805 -0.729518 -0.107670
C -4.400881 -0.650440 0.180833
C 6.623637 -3.174387 0.557309
C -6.481273 0.490960 -0.290853
C -4.587675 1.778722 0.091534
C -6.495717 -2.043486 -0.229445
C -8.486029 -0.809611 -0.681878
H 6.707053 1.484928 0.062117
H 6.459547 -0.533304 1.385344
H 7.851094 -0.666072 0.289186
H 5.067657 -1.944850 -0.231094
H 6.468686 -2.128485 -1.292443
H 4.295755 0.678449 -1.298568
H -1.982327 2.493727 1.664813
H -1.959712 2.660437 -0.109145
H 0.173182 2.839694 2.578785
H -0.175665 0.627196 -1.139834
H 2.673135 2.496472 2.531251
H 2.275416 0.271533 -1.176267
H -1.912046 -0.137341 0.836671
H -3.853150 -1.590548 0.316703
H -4.171434 2.786795 0.178945
H -8.341563 1.319380 -0.706312
H 8.293309 0.577833 -2.998079
H 6.406685 -5.133071 0.543255
H -10.383666 0.036810 -1.100708
H -10.279479 -1.721768 -1.035020


