%chk=000063614.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063614

0 1
 S    1.543700      -1.170100       1.456700    
 F  -0.7406000       3.285300      -1.039200    
 O  -0.2837000      -3.971400       1.500300    
 O    4.582900       2.432700     -0.4966000    
 N   -4.123000      -1.074200     -6.3000001E-02
 N   -1.563900      -2.263300      0.5824000    
 N    3.128300      0.7777000      0.3314000    
 N    3.815400      -1.509400      0.2465000    
 C   -3.997900      -2.510900      0.1984000    
 C   -2.929900     -0.2373000      8.6400002E-02
 C   -2.814600      -2.790000       1.122500    
 C   -1.663600      -1.038900     -0.2152000    
 C   -5.352900     -0.5188000     -0.4075000    
 C  -0.3680000      -2.935900      0.8358000    
 C   -5.680100      0.8159000     -6.9499999E-02
 C   0.8793000      -2.323300      0.2475000    
 C   -6.327700      -1.265900      -1.110600    
 C   -6.911900       1.371800     -0.4150000    
 C   -7.559400     -0.7099000      -1.456200    
 C   -7.851600      0.6087000      -1.108400    
 C    2.954500     -0.5970000      0.5703000    
 C   -7.225000       2.781400     -4.2900000E-02
 C    5.319800      0.2252000     -0.5975000    
 C    4.325500       1.259300     -0.2374000    
 C    5.011600      -1.115700     -0.3628000    
 C    2.107000       1.750700      0.6052000    
 C    6.538100      0.5851000      -1.186000    
 C    5.940600      -2.098100     -0.7254000    
 C    1.164100       2.046400     -0.3703000    
 C    2.077400       2.383500       1.840900    
 C    7.454500     -0.4036000      -1.541800    
 C    7.155900      -1.744600      -1.313000    
 C   0.1735000       2.992100     -0.1052000    
 C    1.087000       3.329000       2.106100    
 C   0.1349000       3.633200       1.133200    
 H   -3.861500      -3.040800     -0.7523000    
 H   -4.903300      -2.899900      0.6800000    
 H   -2.889600      0.1549000       1.110000    
 H   -2.958400      0.6161000     -0.6022000    
 H   -2.723900      -3.866600       1.301700    
 H   -2.967000      -2.308500       2.096300    
 H  -0.7983000     -0.3949000     -5.1500000E-02
 H   -1.655000      -1.348100      -1.267600    
 H   -4.970200       1.426400      0.4853000    
 H   0.6993000      -1.847700     -0.7193000    
 H    1.596300      -3.133300      7.2700001E-02
 H   -6.129900      -2.292800      -1.409300    
 H   -8.290300      -1.303000      -1.998300    
 H   -8.815500       1.029300      -1.382400    
 H   -6.333000       3.413000     -0.1157000    
 H   -7.978100       3.212800     -0.7110000    
 H   -7.604700       2.823700      0.9827000    
 H    6.789200       1.624700      -1.377000    
 H    5.723000      -3.148700     -0.5479000    
 H    1.185800       1.551000      -1.337100    
 H    2.815600       2.153300       2.604300    
 H    8.400400     -0.1281000      -1.998900    
 H    7.869400      -2.515200      -1.589800    
 H    1.057000       3.828300       3.070100    
 H  -0.6366000       4.369100       1.339300    


%chk=000063614-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000063614

0 1
S 1.338124 -0.426247 2.538082
F 0.989642 4.875174 3.546774
O -1.031334 -2.911919 3.645267
O 4.203551 2.754545 -0.211100
N -3.826635 -1.345032 -0.260906
N -1.691675 -1.943568 1.634481
N 2.876287 1.196828 0.946766
N 2.131448 -0.850771 -0.068675
C -3.962069 -2.425967 0.735553
C -2.598802 -0.534583 -0.202890
C -3.119885 -2.127142 1.986703
C -1.406208 -1.372653 0.297219
C -4.845792 -1.082468 -1.192717
C -0.727305 -2.374350 2.530875
C -4.864436 0.128359 -1.951178
C 0.740511 -2.196303 2.141999
C -5.896956 -2.026593 -1.410655
C -5.881242 0.398078 -2.896541
C -6.910882 -1.752593 -2.349092
C -6.912504 -0.554559 -3.097803
C 2.188111 -0.026707 0.954915
C -5.887672 1.716781 -3.654259
C 3.538617 0.716249 -1.367571
C 3.597373 1.650156 -0.227776
C 2.807269 -0.509686 -1.253182
C 2.899753 2.060703 2.120986
C 4.210830 1.035614 -2.575725
C 2.762626 -1.399545 -2.360642
C 1.909375 3.056265 2.257899
C 3.920614 1.901757 3.083210
C 4.159642 0.148320 -3.663292
C 3.433136 -1.070962 -3.551013
C 1.970263 3.877748 3.394417
C 3.944914 2.749770 4.211884
C 2.962732 3.751688 4.381284
H -3.671136 -3.413952 0.315382
H -5.019789 -2.502485 1.051836
H -2.719731 0.363460 0.442956
H -2.348605 -0.177902 -1.218893
H -3.183679 -2.956630 2.710910
H -3.504031 -1.218026 2.490966
H -0.510460 -0.730974 0.340534
H -1.203157 -2.182812 -0.433018
H -4.096313 0.891996 -1.785000
H 0.972832 -2.338558 1.072076
H 1.340313 -2.870840 2.767870
H -5.907855 -2.982010 -0.877589
H -7.702514 -2.494447 -2.508081
H -7.704576 -0.358433 -3.829284
H -4.863089 2.076719 -3.857102
H -6.413713 1.621713 -4.620357
H -6.404970 2.505979 -3.074349
H 4.761095 1.980737 -2.627907
H 2.202276 -2.333528 -2.256824
H 1.126920 3.195705 1.507584
H 4.682290 1.129118 2.944463
H 4.677378 0.391493 -4.596669
H 3.396637 -1.760771 -4.401277
H 4.731358 2.632884 4.963677
H 2.961998 4.419880 5.247001


