%chk=000159093.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000159093

0 1
 S    2.665200     -9.2900001E-02  -1.821600    
 F   -4.278600       3.727700      6.5700002E-02
 F   -2.578400       2.591700      0.8060000    
 O    2.356200      0.8368000      -2.897900    
 O    3.770800      -1.027300      -1.968700    
 O    2.437200      -1.914200       1.242200    
 O  -0.1843000      0.8241000      -1.066600    
 O    4.657100      -1.797500      0.6445000    
 O   -4.482000       1.507800      0.2394000    
 N    1.249000     -0.9705000      -1.422000    
 N  -0.9397000      -1.358700     -0.7237000    
 N   -2.973000      -2.292700     -4.1900001E-02
 N   -2.709100      9.4099998E-02 -0.2440000    
 C    2.940600      0.8179000     -0.3520000    
 C    3.354400      0.1915000      0.8237000    
 C    2.738200       2.197900     -0.3728000    
 C    3.566000      0.9452000       1.978300    
 C    2.949800       2.951500      0.7816000    
 C    3.363600       2.325200       1.957100    
 C    3.575900      -1.247200      0.8845000    
 C  -1.1600000E-02 -0.3887000      -1.060900    
 C   -2.280900      -1.175800     -0.3143000    
 C   -4.248000      -2.081500      0.3458000    
 C   -4.817000     -0.8298000      0.4604000    
 C   -3.992100      0.2319000      0.1497000    
 C   -5.062500      -3.291200      0.6599000    
 C    2.528200      -3.339800       1.337900    
 C   -3.595000       2.564600     -9.0499997E-02
 H    2.413600       2.715200      -1.270700    
 H    1.349200      -1.988600      -1.322500    
 H    3.888300      0.4689000       2.900800    
 H    2.791500       4.025900      0.7659000    
 H    3.527900       2.912100       2.856100    
 H  -0.6393000      -2.328500     -0.7684000    
 H   -5.843600     -0.6856000      0.7737000    
 H   -4.476600      -4.206300      0.5243000    
 H   -5.404500      -3.260600       1.699300    
 H   -5.932800      -3.346700     -1.7000000E-03
 H    1.544800      -3.725000       1.619800    
 H    2.808500      -3.765100      0.3696000    
 H    3.252400      -3.620300       2.108300    
 H   -3.213900       2.505500      -1.115800    


%chk=000159093-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000159093

0 1
S 2.584488 -0.584047 -1.639299
F -3.968289 3.697093 0.646565
F -2.953977 2.591079 2.354016
O 2.287571 0.220247 -3.005359
O 3.666443 -1.789065 -1.633915
O 2.974997 -1.918691 1.112521
O -0.257389 0.569346 -1.132991
O 4.973469 -1.227512 2.101784
O -4.422765 1.490552 0.942899
N 1.013495 -1.407201 -1.119981
N -1.280107 -1.567015 -0.858851
N -3.475942 -2.268807 -0.555649
N -2.824723 -0.011406 0.070140
C 2.943150 0.716392 -0.276109
C 3.586614 0.396516 0.940210
C 2.610449 2.024046 -0.658024
C 3.935642 1.484537 1.784663
C 2.939902 3.082388 0.218642
C 3.611070 2.810451 1.432163
C 3.951246 -0.973251 1.428044
C -0.187359 -0.678280 -1.033111
C -2.574534 -1.249270 -0.434178
C -4.763063 -2.006665 -0.151380
C -5.131753 -0.735797 0.355381
C -4.098169 0.219932 0.439460
C -5.752902 -3.135913 -0.284973
C 3.333887 -3.337372 1.374987
C -3.378870 2.464102 1.001548
H 2.117013 2.200414 -1.618240
H 1.190345 -2.267150 -0.590254
H 4.462807 1.260192 2.717312
H 2.680351 4.109642 -0.054991
H 3.882165 3.630785 2.104242
H -1.179582 -2.535688 -1.174320
H -6.149049 -0.501301 0.669276
H -5.409476 -4.012422 0.292776
H -6.755082 -2.844486 0.067159
H -5.822487 -3.456253 -1.339839
H 2.382090 -3.858062 1.556240
H 3.840292 -3.726071 0.475969
H 3.997110 -3.406132 2.251397
H -2.513577 2.231144 0.362569


