%chk=000077621.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077621

0 1
 S   -2.573100      -1.965400     -0.1704000    
 F    6.943900       1.346900      6.5399997E-02
 O   -2.919300      -2.688000       1.034500    
 O   -2.941000      -2.471000      -1.475500    
 N  -0.8930000      -1.630800     -0.1579000    
 N    1.705500     -0.5026000     -2.2100000E-02
 C  -0.4090000     -0.7470000      -1.255800    
 C  -0.3363000      -1.203300       1.156600    
 C    1.113500     -0.8165000      -1.330400    
 C    1.188100      -1.273700       1.114200    
 C    3.024900     -3.6400001E-02  3.0000001E-04
 C   -3.214100     -0.3275000     -2.1100000E-02
 C    3.386100       1.148800     -0.6695000    
 C    4.030000     -0.7395000      0.6930000    
 C   -3.471900      0.4063000      -1.167500    
 C   -3.448500      0.1973000       1.239400    
 C   -3.978000       1.700800      -1.050200    
 C   -3.954700       1.491800       1.356500    
 C    4.701200       1.613000     -0.6478000    
 C    5.345200     -0.2753000      0.7149000    
 C   -4.219400       2.243500      0.2116000    
 C    5.680900      0.9011000      4.4599999E-02
 C   -4.761100       3.627500      0.3373000    
 H  -0.7046000      0.2909000      -1.069300    
 H  -0.8221000      -1.069200      -2.216800    
 H  -0.6914000      -1.859500       1.957200    
 H  -0.6448000     -0.1766000       1.380900    
 H    1.430400      -1.823100      -1.632000    
 H    1.451500     -0.1228000      -2.108600    
 H    1.573400     -0.8792000       2.062500    
 H    1.507400      -2.319700       1.024500    
 H    2.636700       1.727500      -1.205100    
 H    3.808800      -1.667000       1.215300    
 H   -3.289800      4.0000002E-03  -2.159200    
 H   -3.245700     -0.3695000       2.142900    
 H   -4.178100       2.277400      -1.949500    
 H   -4.136100       1.904800       2.345300    
 H    4.962500       2.530200      -1.167200    
 H    6.109000     -0.8307000       1.251100    
 H   -3.939600       4.348400      0.3953000    
 H   -5.393200       3.883900     -0.5197000    
 H   -5.381400       3.729000       1.234300    


%chk=000077621-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000077621

0 1
S -2.580927 -1.842152 -0.316570
F 7.254779 1.278418 0.196732
O -2.906326 -2.758014 0.986690
O -2.911114 -2.293555 -1.843438
N -0.711154 -1.606959 -0.280494
N 1.907559 -0.563483 -0.108590
C -0.213013 -0.771592 -1.398977
C -0.217395 -1.142376 1.035919
C 1.320776 -0.943635 -1.415609
C 1.321133 -1.298366 1.028436
C 3.261228 -0.136245 -0.041815
C -3.398491 -0.156074 -0.038286
C 3.790447 0.755003 -1.025337
C 4.123901 -0.541622 1.021145
C -3.700352 0.632480 -1.161264
C -3.699189 0.230885 1.278396
C -4.319663 1.882561 -0.941318
C -4.318195 1.485588 1.471089
C 5.116805 1.221305 -0.953233
C 5.450046 -0.065418 1.109900
C -4.628569 2.330247 0.371400
C 5.925192 0.805142 0.118905
C -5.271835 3.686250 0.594882
H -0.464402 0.306122 -1.270959
H -0.643867 -1.150213 -2.341548
H -0.651778 -1.782268 1.822890
H -0.472777 -0.075677 1.232265
H 1.549130 -2.006456 -1.651660
H 1.741509 -0.318371 -2.217767
H 1.706577 -0.876419 1.972619
H 1.570121 -2.383005 0.995789
H 3.156188 1.116891 -1.840076
H 3.779494 -1.252389 1.777062
H -3.493899 0.261006 -2.170499
H -3.491632 -0.444101 2.115268
H -4.575922 2.512703 -1.800749
H -4.573096 1.807477 2.487359
H 5.515402 1.908829 -1.705212
H 6.108911 -0.380407 1.924564
H -4.501041 4.470556 0.724701
H -5.900530 3.983649 -0.262044
H -5.901231 3.692486 1.501436


