%chk=000161562.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161562

0 1
 S   -3.515500      -1.087300       1.163400    
 F    1.788500      -5.041700      0.1696000    
 F    2.078300      -3.725900      -1.530100    
 F    2.796200      -3.133100      0.4350000    
 O   0.3155000      0.9579000      -2.133100    
 N    3.125700       2.523400      0.4840000    
 N   -1.092800      0.3478000     -0.3661000    
 C    2.287700       1.790000     -0.4557000    
 C   0.8602000       1.765900      5.0799999E-02
 C  -0.9612000      -1.041700      5.4000001E-03
 C   3.1999999E-03   1.010900     -0.9433000    
 C   -2.355500       1.039700     -0.2428000    
 C    2.652700       3.901300      0.6314000    
 C    4.523500       2.511200      4.7800001E-02
 C   -1.973000      -1.774000      0.6429000    
 C   -3.476500      0.5067000      0.4065000    
 C   0.2578000      -1.717400     -0.2379000    
 C   0.4450000      -3.063900      8.7099999E-02
 C   -2.507200       2.314100     -0.8392000    
 C   -1.777600      -3.132700      0.9664000    
 C    3.470200       4.662200       1.654600    
 C    5.042100       1.097300     -0.1138000    
 C  -0.5793000      -3.777000      0.6832000    
 C   -4.674200       1.246800      0.4864000    
 C   -3.698000       3.040600     -0.7595000    
 C   -4.783900       2.507900     -8.8299997E-02
 C    1.748100      -3.728800     -0.2047000    
 H    2.605700      0.7462000     -0.5472000    
 H    2.344400       2.236300      -1.457600    
 H   0.7964000       1.295400       1.038700    
 H   0.3973000       2.754600      0.1049000    
 H    2.653900       4.440700     -0.3241000    
 H    1.635600       3.935200       1.029200    
 H    4.663400       3.063600     -0.8901000    
 H    5.164500       2.976800      0.8036000    
 H    1.093000      -1.205000     -0.7103000    
 H   -1.690400       2.781500      -1.384800    
 H   -2.561900      -3.705600       1.458900    
 H    2.961600       5.598800       1.910600    
 H    4.459300       4.940500       1.278100    
 H    3.590700       4.094000       2.583500    
 H    4.795100      0.4701000      0.7499000    
 H    4.670800      0.6148000      -1.023300    
 H    6.134800       1.115200     -0.1987000    
 H  -0.4634000      -4.823400      0.9486000    
 H   -5.545600      0.8411000      0.9984000    
 H   -3.768900       4.019300      -1.224400    
 H   -5.714000       3.062900     -1.8999999E-02


%chk=000161562-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000161562

0 1
S -3.067310 0.766510 1.827357
F 0.869974 -4.793955 1.428530
F 1.503002 -3.734473 -0.481921
F 2.457483 -3.181742 1.496082
O -0.269342 2.304559 -1.908810
N 3.411049 2.483689 0.255133
N -1.153481 0.637060 -0.529506
C 2.045560 2.652854 -0.297912
C 1.282639 1.305234 -0.312520
C -0.974773 -0.445766 0.402580
C -0.077825 1.455469 -0.994609
C -2.515628 0.926607 -0.937330
C 3.433151 2.478118 1.744265
C 4.394684 3.433685 -0.333825
C -1.797646 -0.519083 1.558007
C -3.520735 1.007946 0.057184
C -0.028747 -1.466930 0.164017
C 0.150401 -2.496752 1.112095
C -2.865654 1.118648 -2.293998
C -1.630257 -1.564723 2.492284
C 4.628274 1.698507 2.325550
C 4.816768 3.049306 -1.764584
C -0.641094 -2.545203 2.284511
C -4.859630 1.288209 -0.285080
C -4.200218 1.422995 -2.637892
C -5.196756 1.511003 -1.638747
C 1.213841 -3.530927 0.888802
H 2.110519 3.018749 -1.335364
H 1.452151 3.412926 0.266429
H 1.907652 0.585248 -0.875387
H 1.178807 0.901273 0.709174
H 3.423722 3.520350 2.153953
H 2.499306 2.000461 2.096025
H 4.004436 4.483069 -0.322525
H 5.292680 3.427665 0.310333
H 0.560900 -1.455290 -0.756580
H -2.090564 1.058584 -3.059861
H -2.276920 -1.614069 3.373461
H 4.590144 1.698600 3.431084
H 5.594893 2.141732 2.024996
H 4.609245 0.653917 1.969458
H 5.258231 2.037523 -1.770673
H 3.960092 3.052242 -2.462597
H 5.564926 3.766044 -2.152145
H -0.506216 -3.354816 3.007441
H -5.626310 1.328869 0.495306
H -4.460565 1.588255 -3.688365
H -6.232559 1.741022 -1.908922


