%chk=000118882.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000118882

0 1
 S   -7.662200      0.9725000      1.2800000E-02
 S    7.656300      0.9714000     -1.2900000E-02
 P   -9.285800     -0.3486000      6.5600000E-02
 P    9.286100     -0.3420000     -6.5499999E-02
 O   -10.65780      0.5060000     -7.4000001E-02
 O   -9.309700      -1.223600      -1.300500    
 O    10.65410      0.5191000      7.4199997E-02
 O    9.314000      -1.216800       1.300800    
 O   -9.257800      -1.203600       1.303400    
 O    9.262400      -1.197200      -1.303200    
 N   -2.466200      0.6661000     -1.2700000E-02
 N    2.462100      0.6402000      1.2000000E-02
 C   1.1000000E-02  0.6532000      5.0000002E-04
 C   -1.275600     -0.1752000      2.9000000E-03
 C    1.275300     -0.2079000     -2.3000001E-03
 C   -3.675600     -0.1447000      6.0000003E-04
 C    3.675200     -0.1646000     -1.1000000E-03
 C   -4.916000      0.7497000     -6.6999998E-03
 C    4.911100      0.7356000      6.2000002E-03
 C   -6.190200     -9.0700001E-02  2.9200001E-02
 C    6.189300     -9.8800004E-02 -2.9400000E-02
 H   1.8300001E-02   1.308700     -0.8808000    
 H   1.6200000E-02   1.308500      0.8819000    
 H   -1.281400     -0.8100000      0.8975000    
 H   -1.273400     -0.8366000     -0.8724000    
 H    1.274400     -0.8405000     -0.8980000    
 H    1.267300     -0.8657000      0.8754000    
 H   -3.694200     -0.7747000      0.8983000    
 H   -3.700000     -0.8058000     -0.8744000    
 H    3.696500     -0.7945000     -0.8988000    
 H    3.702600     -0.8255000      0.8739000    
 H   -2.456600       1.261600     -0.8401000    
 H    2.450800       1.235900      0.8394000    
 H   -4.907500       1.378300     -0.9069000    
 H   -4.886400       1.421000      0.8617000    
 H    4.899700       1.364300      0.9063000    
 H    4.878500       1.406700     -0.8623000    
 H   -6.218100     -0.7076000      0.9332000    
 H   -6.235400     -0.7575000     -0.8378000    
 H    6.237600     -0.7654000      0.8376000    
 H    6.220300     -0.7156000     -0.9334000    
 H   -11.51510      4.5899998E-02  5.1100001E-02
 H   -9.947000      -1.965600      -1.374500    
 H    11.51360      6.3000001E-02 -5.0700001E-02
 H    9.954900      -1.955700       1.374900    


%chk=000118882-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000118882

0 1
S -7.584546 0.631105 -1.804976
S 7.543579 0.390269 1.953919
P -8.189390 0.772783 0.371863
P 8.215441 0.801330 -0.168388
O -8.048093 2.408679 0.956096
O -9.897273 0.810517 0.204695
O 8.074002 2.495374 -0.553357
O 9.916200 0.831916 0.060979
O -7.503661 -0.310625 1.315825
O 7.573698 -0.163318 -1.260256
N -2.394951 -0.158346 -0.718823
N 2.398563 -0.239685 0.599792
C 0.005235 -0.205246 -0.072558
C -1.238778 -1.038014 -0.436910
C 1.235994 -1.079533 0.234363
C -3.650491 -0.868063 -1.040924
C 3.637885 -0.991547 0.887956
C -4.814822 0.136406 -1.190611
C 4.803955 -0.019291 1.172412
C -6.129129 -0.574746 -1.535537
C 6.101240 -0.771900 1.492448
H 0.262435 0.482870 -0.902434
H -0.242942 0.426418 0.803866
H -1.511021 -1.690843 0.416602
H -0.990900 -1.718161 -1.292556
H 1.510822 -1.665456 -0.665626
H 0.971652 -1.822850 1.030520
H -3.871831 -1.562480 -0.206467
H -3.574718 -1.494295 -1.967796
H 3.879626 -1.604751 -0.002619
H 3.527204 -1.703713 1.747140
H -2.162908 0.539230 -1.441299
H 2.162772 0.401316 1.371974
H -4.570958 0.877192 -1.978127
H -4.914649 0.689916 -0.239062
H 4.537997 0.644467 2.019283
H 4.942198 0.621927 0.282607
H -6.438450 -1.270716 -0.736901
H -6.073812 -1.122205 -2.493171
H 6.004802 -1.419218 2.382181
H 6.444297 -1.379112 0.637388
H -7.176008 2.634396 1.369160
H -10.349304 1.392247 0.871142
H 7.211284 2.764071 -0.960269
H 10.383356 1.494984 -0.512543


