%chk=000133788.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133788

0 1
 O    1.176600      0.5428000       1.853000    
 O   -2.327300      -2.942600      0.9254000    
 O   0.8832000       1.525800      -1.392100    
 O    2.936700       2.386400      0.6599000    
 O   -1.820800       2.275100     -0.9820000    
 O    5.302600      -1.581100     -0.2819000    
 O   -4.216800       2.645700     -0.3408000    
 O    5.729400       1.833000     -0.9874000    
 N    3.137800      -3.129100     -0.5649000    
 C    1.791400      -1.267400      0.4108000    
 C  -0.8250000      -1.138700      0.3740000    
 C   0.4430000      -1.937300      1.6000000E-03
 C    1.687400      0.2755000      0.5384000    
 C   -2.152000      -1.868500     -8.8999998E-03
 C  -0.7511000      0.2523000     -0.2165000    
 C    2.903300      -1.683500     -0.5723000    
 C   0.6326000      0.7760000     -0.4534000    
 C   -3.344900     -0.9189000      0.1106000    
 C    2.997900       1.022700      0.4006000    
 C   -1.842400      0.9955000     -0.4717000    
 C   -3.179400      0.4610000     -0.1433000    
 C    4.217200      -1.003500     -0.2315000    
 C   -2.158200      -2.466800      -1.426400    
 C    4.171100      0.4506000      8.3999999E-02
 C   -4.628900      -1.412900      0.4080000    
 C   -4.299700       1.307200     -7.6399997E-02
 C    5.393100       1.269600      5.0000001E-02
 C   -5.562600      0.8009000      0.2325000    
 C   -5.727400     -0.5578000      0.4733000    
 C    6.188700       1.389700       1.318900    
 C   -6.755400       1.698100      0.3081000    
 H    2.048900      -1.659800       1.407300    
 H  -0.8192000      -1.029900       1.469100    
 H   0.4519000      -2.089500      -1.085700    
 H   0.4016000      -2.935900      0.4528000    
 H    2.642200      -1.380000      -1.594300    
 H   -3.123900      -2.936700      -1.650700    
 H   -1.416500      -3.266100      -1.530400    
 H   -1.968700      -1.709500      -2.194400    
 H    1.145400       1.507300       1.976000    
 H    2.291100      -3.620600     -0.8468000    
 H    3.841900      -3.363500      -1.264200    
 H   -1.657000      -3.621500      0.7405000    
 H   -4.787400      -2.474300      0.5819000    
 H    3.799000       2.803200      0.5074000    
 H   -6.704700     -0.9713000      0.7076000    
 H  -0.8988000       2.535200      -1.142600    
 H    5.744900      0.7918000       2.120100    
 H    7.205500       1.029700       1.141100    
 H    6.208900       2.436100       1.634200    
 H   -6.595600       2.483100       1.054800    
 H   -7.660600       1.152800      0.5964000    
 H   -6.945500       2.160700     -0.6660000    
 H   -3.297800       2.945600     -0.2668000    


%chk=000133788-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133788

0 1
O 1.460355 0.278635 3.073862
O -2.414308 -3.086261 0.855106
O 0.772776 2.239651 0.563910
O 3.437129 1.794922 2.135261
O -1.561003 2.355897 -0.214906
O 4.002686 -1.040358 -1.709635
O -4.019794 2.599959 -0.778908
O 5.342226 2.240641 0.685043
N 2.127271 -2.837942 -0.669800
C 1.674824 -1.272344 1.203757
C -0.964976 -1.104567 1.186326
C 0.314103 -1.922930 1.564124
C 1.683514 0.214291 1.624139
C -1.940151 -1.843985 0.206439
C -0.674942 0.305003 0.687525
C 2.055611 -1.411581 -0.293755
C 0.540940 0.944006 0.915339
C -3.186098 -0.981054 -0.026806
C 3.022326 0.882043 1.299641
C -1.745362 1.062197 0.078110
C -3.031024 0.435787 -0.180990
C 3.356061 -0.640956 -0.688879
C -1.297687 -2.192036 -1.160375
C 3.783022 0.507190 0.132800
C -4.453870 -1.548502 -0.201593
C -4.154610 1.243860 -0.571101
C 4.971589 1.260677 -0.154400
C -5.445150 0.664567 -0.744426
C -5.563460 -0.724882 -0.540937
C 5.867741 1.067144 -1.335435
C -6.613150 1.541700 -1.135216
H 2.458910 -1.778544 1.805192
H -1.557647 -0.994674 2.118468
H 0.300160 -2.916632 1.081318
H 0.307681 -2.088063 2.653652
H 1.251881 -0.950905 -0.905805
H -2.023252 -2.758924 -1.768990
H -0.379792 -2.798047 -1.032386
H -1.033015 -1.275881 -1.718751
H 1.890386 1.125135 3.384772
H 2.403522 -2.939433 -1.656410
H 2.796964 -3.351075 -0.078473
H -1.693599 -3.763131 0.800080
H -4.575151 -2.625305 -0.064206
H 4.623240 2.276271 1.500129
H -6.550800 -1.186316 -0.664128
H -0.152778 2.598552 0.165471
H 5.292598 1.129459 -2.275559
H 6.668406 1.821861 -1.313540
H 6.293196 0.047902 -1.336164
H -6.770646 2.345578 -0.393068
H -7.541730 0.952726 -1.221765
H -6.423431 2.047682 -2.099600
H -3.025989 2.837694 -0.637556


