%chk=000132196.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000132196

0 1
 S   -3.725700      -1.235500       1.394800    
 P    3.841600      0.2130000      0.2256000    
 P    1.960500       2.468300      2.4599999E-02
 P  -0.2717000       2.233800       1.939300    
 O   0.7174000      -1.510700      0.7942000    
 O  -0.8302000      -4.264900       1.353400    
 O    1.132100      -4.858100     -0.4438000    
 O    3.537000      -1.325000      0.6255000    
 O    2.390800      0.9233000      0.2105000    
 O    4.545900      0.8383000       1.541100    
 O    4.626700      0.3913000      -1.041300    
 O   0.4162000       2.485900      0.4988000    
 O    1.864400       2.653200      -1.578400    
 O    2.839100       3.464800      0.7218000    
 O   0.2591000       3.480100       2.821200    
 O   -1.827600       2.588500       1.684200    
 O  -1.1000000E-02  0.8789000       2.528500    
 N   -1.437400      -1.003300     -6.2300000E-02
 N   -3.135900      0.2305000     -0.8127000    
 N   0.2608000     -0.4122000      -1.695300    
 N  -0.6009000       1.178000      -3.333900    
 N   -2.847100       2.000700      -3.268100    
 N   -5.410000       1.054000       1.693000    
 C  -0.6912000      -3.375100      0.2470000    
 C   0.6673000      -3.525700     -0.4116000    
 C  -0.6623000      -1.934200      0.7597000    
 C    1.544400      -2.634600      0.4506000    
 C    2.798400      -2.152900     -0.2567000    
 C  -0.9683000     -0.3432000      -1.161900    
 C   -2.743600     -0.6267000      0.1067000    
 C   -2.036100      0.4166000      -1.612100    
 C   -1.819600       1.198500      -2.742300    
 C   0.3495000      0.3856000      -2.781800    
 C   -4.732400      0.1189000       1.581500    
 H   -1.511200      -3.591800     -0.4452000    
 H   0.6146000      -3.146100      -1.438700    
 H   -1.026400      -1.852100       1.788400    
 H    1.825000      -3.133100       1.387400    
 H    2.558400      -1.596900      -1.167600    
 H    3.435800      -2.997200     -0.5360000    
 H   -1.698400      -4.092800       1.756400    
 H    2.019000      -4.852800     -0.8417000    
 H    1.311300      0.3891000      -3.283400    
 H   -3.757200       2.018300      -2.828100    
 H   -2.664900       2.560300      -4.090000    
 H    4.934200       1.737500       1.488400    
 H    1.694900       3.547300      -1.944300    
 H   5.1600002E-02   3.506100       3.779500    
 H   -2.475200       2.429400       2.403500    


%chk=000132196-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000132196

0 1
S -4.038966 -0.709681 1.594847
P 4.271142 0.570145 0.813961
P 2.749003 3.315163 0.946313
P -0.288767 2.390707 0.996116
O 0.194087 -1.269181 0.926512
O -0.840125 -4.285675 1.370133
O 1.489154 -4.555299 0.130870
O 3.017913 -0.555983 1.185501
O 3.289316 1.906119 0.123672
O 4.729328 1.108435 2.333088
O 5.361325 0.064424 -0.204715
O 1.088245 3.384907 0.591579
O 3.242288 4.640051 0.016263
O 3.296738 3.325218 2.441437
O 0.394973 1.143541 1.898764
O -0.984323 3.439237 2.117304
O -1.116857 1.972147 -0.291004
N -1.906093 -1.212689 -0.241202
N -3.636662 0.068073 -1.061998
N -0.481123 -1.273848 -2.283528
N -1.451298 0.034260 -4.128148
N -3.494938 1.198554 -3.942162
N -3.079937 1.839040 2.719585
C -0.706074 -3.403913 0.220034
C 0.793177 -3.305302 -0.197292
C -1.089849 -1.979171 0.695849
C 1.350226 -2.190112 0.711083
C 2.500365 -1.415630 0.094173
C -1.583181 -0.902123 -1.572955
C -3.155725 -0.583904 -0.005441
C -2.658362 -0.107980 -2.049460
C -2.553221 0.388902 -3.383273
C -0.504788 -0.762062 -3.555539
C -3.480197 0.803833 2.283044
H -1.353059 -3.740933 -0.611420
H 0.870281 -3.032255 -1.263408
H -1.640379 -2.058657 1.648626
H 1.650652 -2.610502 1.688499
H 2.149097 -0.803999 -0.757786
H 3.289817 -2.115791 -0.238034
H -0.065284 -4.916498 1.337963
H 1.653922 -5.086684 -0.685929
H 0.347342 -1.017027 -4.192630
H -4.291203 1.515238 -3.391827
H -3.348955 1.541603 -4.890262
H 4.247027 1.960743 2.659883
H 2.556497 4.961925 -0.626226
H 0.358330 0.184436 1.518076
H -1.829181 3.063498 2.539462


