%chk=000051210.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051210

0 1
 S   0.7370000     -0.1955000       1.709400    
 F    5.406000       1.555000      0.9669000    
 O   -1.590100      -5.016900     -0.8629000    
 N   -1.455700      0.8566000     -0.3028000    
 N   -3.594700       2.743100      0.1713000    
 C  -0.7886000     -0.1864000      -1.079400    
 C   -1.564700       2.096900      -1.080500    
 C   -2.782800      0.4099000      0.1385000    
 C   -2.267800       3.190600     -0.2692000    
 C   -3.484600       1.503900      0.9505000    
 C   0.5467000      0.2875000      -1.676400    
 C  -0.6382000      -1.500900     -0.3419000    
 C    1.774900      0.5903000     -0.8379000    
 C   5.5199999E-02  -1.611300      0.8748000    
 C   -4.263400       3.786100      0.9465000    
 C   -1.183200      -2.664300     -0.9157000    
 C    1.951700      0.4037000      0.5453000    
 C    2.867400       1.100600      -1.581300    
 C   0.1775000      -2.862500       1.498400    
 C   -1.051100      -3.904900     -0.2924000    
 C    3.188900      0.7460000       1.133600    
 C  -0.3703000      -4.003800      0.9150000    
 C    4.084600       1.426700     -0.9864000    
 C    4.245100       1.249700      0.3769000    
 H   -1.427800     -0.3853000      -1.954300    
 H   -2.099700       1.932400      -2.025300    
 H  -0.5814000       2.516100      -1.313400    
 H   -2.715700     -0.4690000      0.7891000    
 H   -3.410400      0.1336000     -0.7200000    
 H   -1.644500       3.471200      0.5910000    
 H   -2.368900       4.080200     -0.9029000    
 H   -4.486000       1.145600       1.218800    
 H   -2.937300       1.677000       1.887300    
 H   0.3839000       1.116600      -2.376200    
 H   0.8738000     -0.5341000      -2.336300    
 H   -5.270500       3.464800       1.234500    
 H   -4.383300       4.694400      0.3455000    
 H   -3.710700       4.045500       1.856700    
 H   -1.716900      -2.606900      -1.862200    
 H    2.768500       1.247300      -2.656200    
 H   0.6999000      -2.963500       2.447400    
 H    3.349400      0.6206000       2.203700    
 H  -0.2608000      -4.961900       1.415800    
 H    4.899800       1.815700      -1.588600    
 H   -1.403500      -5.784600     -0.2956000    


%chk=000051210-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000051210

0 1
S 0.884951 -0.635012 1.705304
F 4.530836 2.889531 1.299427
O -2.135458 -5.173883 -0.923969
N -1.279415 0.672259 -0.440425
N -3.157859 2.785655 0.234809
C -0.721708 -0.471296 -1.208719
C -1.374959 1.910918 -1.254506
C -2.593011 0.372020 0.185733
C -1.850816 3.090095 -0.390545
C -3.054004 1.553856 1.051917
C 0.718121 -0.174690 -1.743820
C -0.718751 -1.780489 -0.420515
C 1.673059 0.607257 -0.846617
C 0.031545 -1.965813 0.772499
C -3.697349 3.927055 0.996958
C -1.415850 -2.886476 -0.955050
C 1.838677 0.438941 0.557331
C 2.507403 1.563663 -1.490602
C 0.052825 -3.229461 1.408964
C -1.400070 -4.144170 -0.312872
C 2.798878 1.208493 1.267921
C -0.665605 -4.322328 0.881573
C 3.466568 2.339432 -0.809323
C 3.582298 2.137144 0.574617
H -1.348585 -0.664306 -2.120672
H -2.085469 1.775885 -2.110508
H -0.380225 2.159195 -1.662428
H -2.491398 -0.523996 0.821533
H -3.375220 0.163388 -0.587533
H -1.065380 3.304920 0.378919
H -1.960622 3.987875 -1.028065
H -4.048523 1.327118 1.480294
H -2.329550 1.679561 1.896829
H 0.631170 0.380564 -2.695822
H 1.166868 -1.152087 -2.009637
H -4.694440 3.668709 1.397151
H -3.813084 4.799538 0.328592
H -3.048648 4.234440 1.856921
H -1.992467 -2.778754 -1.879422
H 2.393967 1.701517 -2.572659
H 0.645007 -3.361353 2.320479
H 2.941739 1.079549 2.345350
H -0.636286 -5.295198 1.388069
H 4.096498 3.070275 -1.322815
H -2.067955 -6.013737 -0.405565


