%chk=000105649.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000105649

0 1
 O   -2.107500       1.351100       1.304600    
 C   -1.923900      -1.201500     -0.1367000    
 C   -2.506900      0.1024000     -0.7449000    
 C   -2.800800      -1.669500       1.044300    
 C   -1.991600      -2.292200      -1.229800    
 C  -0.4715000      -1.130900      0.3232000    
 C   -2.514800       1.342800      0.1449000    
 C   0.4874000     -0.3035000     -0.1262000    
 C    1.843300     -0.3261000      0.3830000    
 C   -3.045100       2.602600     -0.4916000    
 C    2.873100      0.4565000      2.0999999E-03
 C    4.228300      0.2863000      0.6624000    
 C    2.820900       1.506700      -1.076500    
 C    5.109200     -0.7247000     -5.8699999E-02
 H   -3.549000     -7.2800003E-02  -1.043600    
 H   -1.956000      0.3669000      -1.656500    
 H   -2.506300      -2.668200       1.389400    
 H   -3.856400      -1.724900      0.7544000    
 H   -2.726400     -0.9992000       1.906500    
 H   -3.022100      -2.447700      -1.569700    
 H   -1.617900      -3.255700     -0.8624000    
 H   -1.391900      -2.017900      -2.105900    
 H  -0.1924000      -1.868200       1.076900    
 H   0.2423000      0.4176000     -0.8960000    
 H    2.028700      -1.059400       1.167500    
 H   -2.413900       2.877300      -1.340300    
 H   -4.074100       2.441200     -0.8221000    
 H   -3.033500       3.417700      0.2373000    
 H    4.739800       1.255000      0.7145000    
 H    4.100300     -3.7400000E-02   1.703200    
 H    1.854300       1.580700      -1.578200    
 H    3.043300       2.490400     -0.6496000    
 H    3.567400       1.291100      -1.848100    
 H    6.071500     -0.8196000      0.4545000    
 H    4.640400      -1.714100     -8.2599998E-02
 H    5.306500     -0.4155000      -1.090400    


%chk=000105649-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000105649

0 1
O -2.393287 1.449675 1.211711
C -2.071683 -1.318800 -0.036045
C -2.504548 -0.019475 -0.772532
C -2.938495 -1.563124 1.236036
C -2.304730 -2.510080 -1.021349
C -0.596655 -1.322792 0.351284
C -2.402489 1.327021 -0.040750
C 0.364862 -0.407364 0.027338
C 1.766462 -0.533048 0.426471
C -2.343303 2.555475 -0.949826
C 2.792180 0.341984 0.164133
C 4.203509 0.040878 0.653255
C 2.625554 1.640294 -0.606192
C 5.240920 -0.123796 -0.490576
H -3.575033 -0.125754 -1.057116
H -1.958359 0.070187 -1.733571
H -2.662705 -2.526519 1.705025
H -4.012148 -1.612405 0.969063
H -2.795805 -0.752346 1.966467
H -3.376943 -2.595929 -1.284309
H -1.993297 -3.463387 -0.556239
H -1.722588 -2.380139 -1.952209
H -0.294561 -2.201782 0.945461
H 0.085448 0.476876 -0.561344
H 2.009256 -1.438754 1.004519
H -1.330533 2.640614 -1.391993
H -3.055426 2.468972 -1.791047
H -2.551142 3.468432 -0.370266
H 4.544929 0.863853 1.317136
H 4.193646 -0.879643 1.267352
H 1.569485 1.925139 -0.742264
H 3.132947 2.470977 -0.077724
H 3.087287 1.574637 -1.611449
H 6.239153 -0.361160 -0.079027
H 4.945938 -0.942170 -1.172195
H 5.336852 0.800752 -1.088328


