%chk=000154957.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154957

0 1
 S    5.561900     -0.2107000       1.305200    
 F   -1.158100      -4.566700     -0.4908000    
 O    1.535800      0.7627000      -2.969900    
 O    6.791300      0.2633000       1.913000    
 O    4.644000      -1.046000       2.054000    
 N  -0.5613000      0.4082000      -1.127300    
 N   -4.138600     -0.1744000      0.9779000    
 N    4.742600       1.136500      0.6121000    
 C   -1.774400      0.2107000     -0.4135000    
 C   -2.189200      -1.087000     -9.7400002E-02
 C   -2.542700       1.315600     -3.3300001E-02
 C   -3.394600      -1.235200      0.6093000    
 C   -3.734300       1.073400      0.6708000    
 C   0.7622000      0.5907000     -0.7052000    
 C   -1.436900      -2.215500     -0.4670000    
 C   -2.150000       2.630600     -0.3378000    
 C    1.797100      0.7667000      -1.632100    
 C    3.398400      0.9527000      0.1674000    
 C    1.060500      0.5980000      0.6628000    
 C   -3.813100      -2.524700      0.9269000    
 C   -4.503800       2.169300       1.052200    
 C    3.110100      0.9469000      -1.197300    
 C    2.373500      0.7782000       1.097400    
 C   -1.877200      -3.493800     -0.1373000    
 C   -2.937200       3.708900      5.4900002E-02
 C   -3.067900      -3.648300      0.5611000    
 C   -4.116400       3.477500      0.7514000    
 C    6.021800      -1.091700     -0.1701000    
 C    1.596500     -0.4959000      -3.637400    
 H  -0.6992000      0.4524000      -2.132600    
 H  -0.5036000      -2.131200      -1.017200    
 H   -1.236400       2.847100     -0.8852000    
 H   0.2835000      0.4672000       1.411600    
 H   -4.742600      -2.672000       1.473800    
 H   -5.432300       2.014000       1.598900    
 H    3.906500       1.081800      -1.925600    
 H    2.580300      0.7930000       2.164400    
 H   -2.632300       4.723500     -0.1824000    
 H   -3.420300      -4.641500      0.8231000    
 H   -4.738100       4.312000       1.062300    
 H    5.313500       1.718700     -1.5300000E-02
 H    6.616300     -0.4340000     -0.8070000    
 H    6.620400      -1.955500      0.1281000    
 H    5.121200      -1.430500     -0.6846000    
 H   0.8837000      -1.203200      -3.202100    
 H    2.609900     -0.9064000      -3.586600    
 H    1.335300     -0.3392000      -4.687500    


%chk=000154957-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154957

0 1
S 5.728648 -1.419869 0.037686
F -0.516404 -4.323340 0.468153
O 1.266468 1.430909 -2.783900
O 4.690609 -2.336473 -0.836705
O 7.242956 -1.117201 -0.512976
N -0.582780 0.699773 -1.085510
N -4.323233 -0.258866 0.823303
N 4.823112 0.457227 0.581378
C -1.787467 0.360414 -0.421666
C -2.023511 -0.942401 0.123045
C -2.832389 1.339629 -0.368097
C -3.314936 -1.183165 0.767950
C -4.100249 0.965860 0.249611
C 0.732745 0.596677 -0.623718
C -1.092065 -2.032396 0.011608
C -2.682313 2.678589 -0.872920
C 1.765397 0.999845 -1.541553
C 3.488741 0.520074 0.135971
C 1.110673 0.177220 0.680285
C -3.576956 -2.476019 1.349722
C -5.171036 1.926061 0.283210
C 3.113998 0.952277 -1.178611
C 2.463588 0.130116 1.046390
C -1.421792 -3.251386 0.577674
C -3.740471 3.583617 -0.818981
C -2.646808 -3.503889 1.267871
C -5.001460 3.201222 -0.246916
C 5.887343 -2.225346 1.758841
C 2.236670 1.812888 -3.815397
H -0.663542 1.198058 -1.978542
H -0.142366 -1.920131 -0.515876
H -1.717415 3.001401 -1.279008
H 0.339078 -0.095582 1.404601
H -4.544190 -2.611460 1.841355
H -6.110538 1.606969 0.744291
H 3.897921 1.225769 -1.892485
H 2.756918 -0.176535 2.055204
H -3.608825 4.601274 -1.202317
H -2.829763 -4.493693 1.695506
H -5.822658 3.925357 -0.217005
H 5.461723 1.010441 -0.031134
H 4.864485 -2.345882 2.139368
H 6.389391 -3.189091 1.594542
H 6.483624 -1.532183 2.365937
H 2.895714 0.961047 -4.066170
H 2.844305 2.677023 -3.485660
H 1.634860 2.091372 -4.692250


