%chk=000141783.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000141783

0 1
 S    3.578800       1.429800       1.330000    
 F    2.306800      -5.038500      0.1739000    
 F   0.2623000      -4.314800      0.1645000    
 F    1.468400      -4.181000      -1.640000    
 O   -6.516900      0.2143000      0.7003000    
 O  -0.4382000      0.5356000      -2.246800    
 N   -3.745000     -0.1911000      0.1967000    
 N   0.9157000      0.9082000     -0.3743000    
 C   -2.575300     -0.2029000     -0.6794000    
 C   -4.322100       1.157700      0.2783000    
 C   -4.759100      -1.145000     -0.2740000    
 C   -1.512800      0.7194000     -0.1182000    
 C   -5.547200       1.142300       1.188000    
 C   -5.974500      -1.105800      0.6479000    
 C  -0.3058000      0.6849000      -1.031600    
 C    1.695600     -0.2219000      7.5999998E-02
 C    1.411800       2.258600     -0.2463000    
 C    2.872300     -0.1076000      0.8275000    
 C    2.585800       2.592200      0.4442000    
 C    1.291200      -1.529400     -0.2846000    
 C    1.995500      -2.667600      0.1157000    
 C   0.6737000       3.329700     -0.8030000    
 C    3.576400      -1.260800       1.231400    
 C    3.015600       3.933300      0.5188000    
 C    3.139000      -2.533400      0.8824000    
 C    1.104900       4.656900     -0.7236000    
 C    2.284700       4.959300     -6.8200000E-02
 C    1.518200      -4.022300     -0.2855000    
 H   -2.852400      9.0800002E-02  -1.700600    
 H   -2.169400      -1.221000     -0.7396000    
 H   -3.634500       1.882100      0.7217000    
 H   -4.609400       1.514800     -0.7191000    
 H   -5.069800     -0.8960000      -1.297200    
 H   -4.351100      -2.162200     -0.2807000    
 H   -1.819700       1.768100     -9.0800002E-02
 H   -1.223700      0.4179000      0.8953000    
 H   -5.282200      0.8857000       2.221000    
 H   -6.013900       2.132500       1.202500    
 H   -6.754800      -1.770900      0.2642000    
 H   -5.723900      -1.439200       1.662400    
 H   0.4004000      -1.687100     -0.8893000    
 H  -0.2549000       3.156600      -1.342000    
 H    4.486200      -1.177600       1.824000    
 H    3.708200      -3.398300       1.209600    
 H    3.928400       4.196400       1.051400    
 H   0.5147000       5.446700      -1.178700    
 H    2.628900       5.986300     -1.9999999E-04


%chk=000141783-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000141783

0 1
S 2.894195 1.805554 1.932126
F 0.944938 -4.519964 0.184792
F -0.771900 -3.300515 -0.674835
F 1.140095 -3.551579 -1.855864
O -6.328154 -1.413069 0.964366
O -1.057158 2.957739 -0.898134
N -3.715666 -0.355007 0.280120
N 0.740424 1.621277 -0.206729
C -2.655528 0.321977 -0.499753
C -4.834425 0.546297 0.657633
C -4.232779 -1.593192 -0.359490
C -1.635346 1.017152 0.443733
C -5.805393 -0.190014 1.595763
C -5.208904 -2.297987 0.597083
C -0.653369 1.925615 -0.293352
C 1.230632 0.337382 0.220376
C 1.738425 2.628176 -0.516826
C 2.232678 0.258179 1.225067
C 2.812187 2.813771 0.390253
C 0.758624 -0.850206 -0.375722
C 1.194628 -2.104692 0.105442
C 1.676944 3.417866 -1.689023
C 2.688779 -0.997187 1.681015
C 3.810312 3.778446 0.144665
C 2.154994 -2.184289 1.139559
C 2.662341 4.401379 -1.923892
C 3.726103 4.585587 -1.011779
C 0.647166 -3.345031 -0.535334
H -3.065602 1.076934 -1.210745
H -2.136930 -0.446559 -1.102626
H -4.433079 1.438608 1.173929
H -5.392540 0.897955 -0.246637
H -4.760944 -1.376384 -1.321701
H -3.383095 -2.267521 -0.577373
H -2.195288 1.695984 1.114552
H -1.145786 0.259647 1.073814
H -5.281706 -0.449534 2.541365
H -6.690631 0.428467 1.818294
H -5.672204 -3.176127 0.117978
H -4.664929 -2.613803 1.513550
H 0.041979 -0.789851 -1.199492
H 0.848922 3.277572 -2.385128
H 3.460232 -1.045552 2.455423
H 2.491034 -3.158321 1.505319
H 4.641543 3.895533 0.847391
H 2.598513 5.020722 -2.824461
H 4.492567 5.344268 -1.200711


