%chk=000178571.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000178571

0 1
 S  -0.2561000       1.000700      -1.015700    
 S   -2.839000       3.227300     -0.6973000    
 P   -1.949000       1.502200      0.1241000    
 O  -0.9919000      -2.193400      0.5039000    
 O    4.119200      0.1206000     -0.2118000    
 O   -3.017500      0.2748000      0.1129000    
 O  -0.3938000      -2.167300      -1.721200    
 O   -1.518900       1.807600       1.537900    
 O    2.484100       1.058400       1.117800    
 C   0.4449000     -0.4655000     -0.1826000    
 C    1.924900     -0.6457000     -0.5289000    
 C  -0.3349000      -1.701600     -0.5908000    
 C    2.841100      0.2798000      0.2445000    
 C   -1.805000      -3.347600      0.2694000    
 C    5.103100      0.9543000      0.4085000    
 C   -2.458000      -3.763400       1.570400    
 C    6.456100      0.6591000     -0.2031000    
 C   -4.246500       3.588500      0.3714000    
 C   -3.562700     -0.1887000      -1.109600    
 H   0.3348000     -0.3155000      0.8974000    
 H    2.233500      -1.668300     -0.2754000    
 H    2.097500     -0.5054000      -1.603100    
 H   -2.574400      -3.110500     -0.4731000    
 H   -1.178200      -4.164000     -0.1062000    
 H    4.845100       2.006700      0.2459000    
 H    5.130500      0.7484000       1.484400    
 H   -3.087100      -4.646300       1.427700    
 H   -3.074500      -2.950300       1.968000    
 H   -1.699900      -3.987400       2.328000    
 H    7.233800       1.280700      0.2492000    
 H    6.439400      0.8430000      -1.282400    
 H    6.720200     -0.3945000     -6.4300001E-02
 H   -4.770500       4.474800      5.7000001E-03
 H   -3.902400       3.774100       1.391900    
 H   -4.938100       2.742300      0.3756000    
 H   -4.232600      0.5659000      -1.528600    
 H   -2.775000     -0.4233000      -1.827800    
 H   -4.139700      -1.095100     -0.9108000    


%chk=000178571-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178571

0 1
S -0.016784 0.889697 -0.120549
S -2.795983 2.900576 -0.588995
P -2.298118 0.805351 0.277995
O -1.177897 -2.249233 0.942205
O 4.054035 0.325393 -0.401121
O -2.925506 -0.371913 -0.842811
O -0.290456 -2.487126 -1.209114
O -2.893631 0.552156 1.731918
O 3.111894 0.069289 1.716370
C 0.654798 -0.851650 0.393234
C 2.046278 -0.977472 -0.252412
C -0.296674 -1.945522 -0.077763
C 3.089093 -0.143780 0.482369
C -2.297582 -3.201281 0.632977
C 5.173084 1.118679 0.206642
C -3.189900 -3.220613 1.868378
C 6.075949 1.555226 -0.941386
C -3.953019 3.438538 0.814171
C -2.652634 -0.216595 -2.290933
H 0.719894 -0.839499 1.491196
H 2.361457 -2.038214 -0.183171
H 2.028483 -0.725382 -1.323965
H -2.818660 -2.809987 -0.257462
H -1.851799 -4.184566 0.397318
H 4.730518 1.971760 0.751286
H 5.692884 0.473743 0.938027
H -4.060667 -3.877040 1.687423
H -3.551893 -2.202564 2.090456
H -2.644413 -3.600349 2.749244
H 6.921169 2.147202 -0.545579
H 5.522107 2.179865 -1.662596
H 6.484722 0.682018 -1.477788
H -3.623146 4.434840 1.141493
H -3.866247 2.717447 1.645451
H -4.983857 3.460657 0.434593
H -2.996806 0.772139 -2.646673
H -1.578812 -0.360012 -2.502135
H -3.239381 -1.016379 -2.766392


