%chk=000095749.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000095749

0 1
 O    5.949900      0.9623000     -0.1233000    
 O   -5.949600      0.9636000      0.1134000    
 N    1.445600     -0.8221000      9.1000004E-03
 N   -1.445500     -0.8220000     -6.0000001E-03
 C   0.6813000      0.3855000      0.3448000    
 C   0.6814000      -2.026200      0.3576000    
 C  -0.6814000      0.3814000     -0.3566000    
 C  -0.6818000      -2.029700     -0.3427000    
 C    2.743600     -0.8185000      0.6809000    
 C   -2.744400     -0.8256000     -0.6759000    
 C    3.717100      9.7999997E-02 -5.3100001E-02
 C   -3.716900      9.8800004E-02  4.9500000E-02
 C    5.086900      0.1055000      0.6119000    
 C   -5.087700      9.9100001E-02 -0.6135000    
 C    7.286700      0.6603000     -0.1013000    
 C   -7.286500      0.6615000      9.6600004E-02
 C    7.841900      3.1500001E-02   1.013300    
 C   -7.843100      2.0600000E-02  -1.010300    
 C    8.092400      0.9824000      -1.193600    
 C   -8.090700      0.9954000       1.186500    
 C    9.202500     -0.2749000       1.035900    
 C   -9.203700     -0.2861000      -1.027500    
 C    9.453100      0.6758000      -1.170900    
 C   -9.451300      0.6885000       1.169200    
 C    10.00790      4.7100000E-02 -5.6200001E-02
 C   -10.00780      4.7800001E-02  6.2199999E-02
 H    1.211300       1.287600      2.1700000E-02
 H   0.5327000      0.4671000       1.430400    
 H   0.5400000      -2.097900       1.444700    
 H    1.229600      -2.921300      3.9099999E-02
 H   -1.211200       1.287300     -4.4199999E-02
 H  -0.5330000      0.4500000      -1.443100    
 H  -0.5406000      -2.112400      -1.429000    
 H   -1.230000      -2.921500     -1.5000000E-02
 H    2.654300     -0.5367000       1.737900    
 H    3.173500      -1.828800      0.6625000    
 H   -2.656700     -0.5552000      -1.736100    
 H   -3.174200      -1.835700     -0.6460000    
 H    3.353300       1.131000     -9.1399997E-02
 H    3.825400     -0.2186000      -1.098900    
 H   -3.353100       1.132100      7.6200001E-02
 H   -3.823700     -0.2066000       1.098800    
 H    5.003600      0.4766000       1.640000    
 H    5.458800     -0.9273000      0.6260000    
 H   -5.005800      0.4589000      -1.645800    
 H   -5.459500     -0.9338000     -0.6159000    
 H    7.256100     -0.2111000       1.894900    
 H   -7.258600     -0.2316000      -1.890100    
 H    7.665600       1.472200      -2.064500    
 H   -7.662600       1.494600       2.051500    
 H    9.636400     -0.7587000       1.906200    
 H   -9.638900     -0.7793000      -1.891900    
 H    10.08060      0.9269000      -2.021100    
 H   -10.07750      0.9488000       2.017600    
 H    11.06760     -0.1902000     -3.8100000E-02
 H   -11.06740     -0.1897000      4.8099998E-02


%chk=000095749-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000095749

0 1
O 5.948957 0.732717 -0.366231
O -5.949484 0.734799 0.361684
N 1.454727 -1.281829 -0.082312
N -1.455132 -1.282100 0.093407
C 0.702842 -0.064763 0.314234
C 0.699860 -2.493916 0.325242
C -0.703692 -0.066232 -0.307693
C -0.699669 -2.495493 -0.309182
C 2.844553 -1.306194 0.434146
C -2.844683 -1.309169 -0.423669
C 3.740419 -0.217866 -0.194079
C -3.741004 -0.217634 0.198305
C 5.205464 -0.401022 0.210073
C -5.205852 -0.403560 -0.205270
C 7.332196 0.801128 -0.128789
C -7.332403 0.801946 0.122007
C 8.064277 -0.146515 0.630259
C -8.064039 -0.151779 -0.629828
C 7.991439 1.913737 -0.710240
C -7.991765 1.919811 0.693142
C 9.457709 0.031978 0.800714
C -9.457166 0.025959 -0.803509
C 9.378764 2.076452 -0.530912
C -9.378782 2.081703 0.510706
C 10.122588 1.136818 0.226101
C -10.122163 1.136025 -0.239184
H 1.244154 0.829834 -0.039798
H 0.605072 0.005213 1.428130
H 0.587979 -2.554120 1.438012
H 1.256751 -3.387972 -0.013539
H -1.245390 0.829463 0.042967
H -0.605918 -0.000407 -1.421836
H -0.587719 -2.560145 -1.421701
H -1.256199 -3.388411 0.033183
H 2.870067 -1.209767 1.552958
H 3.265314 -2.302488 0.189885
H -2.869530 -1.218373 -1.542971
H -3.265482 -2.304266 -0.174622
H 3.422644 0.792157 0.122572
H 3.649103 -0.264870 -1.294065
H -3.423535 0.790666 -0.124086
H -3.649880 -0.258324 1.298561
H 5.318869 -0.398223 1.315392
H 5.614076 -1.355109 -0.185062
H -5.318556 -0.409267 -1.310655
H -5.615014 -1.354432 0.196962
H 7.571327 -1.010659 1.085088
H -7.570947 -1.020062 -1.076567
H 7.400242 2.628362 -1.291304
H -7.400910 2.639072 1.268807
H 10.021700 -0.701703 1.388107
H -10.020824 -0.712435 -1.385290
H 9.882127 2.938598 -0.982755
H -9.882247 2.947941 0.954536
H 11.201180 1.266417 0.363531
H -11.200513 1.265011 -0.379060


