%chk=000177100.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000177100

0 1
 S  -0.9078000     -0.5194000      -2.447800    
 O    1.449000     -0.3999000     -0.1235000    
 O    1.888500       2.751700      -1.951300    
 O    3.806900       2.953400      0.2117000    
 O    4.910600      0.3583000      0.8314000    
 O   6.1700001E-02  -1.058500      -3.384000    
 O   -2.174800     -1.7899999E-02  -2.948100    
 O    3.935600      -2.056300       1.710200    
 O    1.658200      -2.043000       1.805300    
 O   -3.082200       3.961300      0.4458000    
 N  -0.1395000      0.6819000      -1.460400    
 N  -0.9247000      0.4900000      0.7551000    
 N   -2.399700       2.140100       1.708100    
 N   -2.163300      -4.845500       1.433800    
 C    1.908400       1.882100     -0.8208000    
 C    1.310000      0.5266000      -1.196000    
 C    3.362300       1.727300     -0.3725000    
 C    3.516900      0.6155000      0.6650000    
 C    2.811000     -0.6549000      0.2029000    
 C    2.705300      -1.648600       1.313800    
 C  -0.9398000       1.212500     -0.3718000    
 C   -1.281900      -1.809000      -1.290500    
 C   -1.629800       2.378600     -0.5598000    
 C   -2.497700      -1.789300     -0.6342000    
 C  -0.3493000      -2.804700      -1.070800    
 C   -2.356200       2.803100      0.5339000    
 C   -1.671300       1.008200       1.748800    
 C   -2.792100      -2.803800      0.2766000    
 C  -0.6439000      -3.819300     -0.1600000    
 C   -1.865400      -3.818700      0.5136000    
 C   -1.693600      0.2482000       3.031400    
 C   -3.811400       4.350000       1.604100    
 H    1.355800       2.381000     -1.7200001E-02
 H    1.806700      0.1399000      -2.093700    
 H    4.011900       1.544000      -1.237900    
 H    3.123000      0.9468000       1.634500    
 H    3.311300      -1.138900     -0.6449000    
 H    2.371100       2.317300      -2.675200    
 H    4.763300       2.877600      0.3667000    
 H    5.307200       1.138500       1.253900    
 H   -1.610800       2.930900      -1.490400    
 H   -3.231400      -1.007300     -0.8028000    
 H   0.6085000      -2.819700      -1.581100    
 H    3.887500      -2.708600       2.441200    
 H   -3.746700      -2.791300      0.7966000    
 H   8.7600000E-02  -4.603500      1.7600000E-02
 H   -2.672600     -0.2209000       3.167200    
 H  -0.9297000     -0.5357000       3.040300    
 H   -1.503500      0.9202000       3.873800    
 H   -1.490600      -5.580300       1.607600    
 H   -3.047600      -4.844400       1.924400    
 H   -4.332800       5.284300       1.375700    
 H   -3.138300       4.536800       2.447600    
 H   -4.564300       3.598500       1.864800    


%chk=000177100-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000177100

0 1
S -0.506427 -0.332673 -2.316024
O 1.854513 -0.427684 0.212484
O 2.146556 3.156945 -1.045731
O 4.646504 2.712142 0.333940
O 5.549692 -0.053585 0.488962
O 0.870353 -0.835162 -3.023685
O -1.611732 0.460318 -3.201536
O 3.030510 -3.168204 0.614808
O 3.653510 -1.875176 2.441469
O -4.231947 2.285105 0.449029
N 0.190591 0.887727 -0.925289
N -0.241574 1.589090 1.303864
N -2.454923 2.283798 2.011924
N -3.292998 -4.868892 0.535148
C 2.358457 1.955353 -0.225313
C 1.593488 0.707562 -0.737965
C 3.860223 1.605338 -0.212416
C 4.163530 0.382241 0.664962
C 3.287271 -0.805064 0.231667
C 3.365984 -1.956401 1.232888
C -0.724769 1.364752 0.033336
C -1.358069 -1.704357 -1.396852
C -2.072549 1.619863 -0.310331
C -2.741830 -1.868596 -1.602318
C -0.592229 -2.550093 -0.570214
C -2.901468 2.061607 0.747620
C -1.118055 2.061529 2.230712
C -3.387752 -2.931597 -0.952649
C -1.249093 -3.609246 0.074208
C -2.653211 -3.818780 -0.105711
C -0.589701 2.362848 3.610593
C -5.086990 2.791345 1.545454
H 1.996423 2.219354 0.778239
H 2.009047 0.401224 -1.728542
H 4.187217 1.388330 -1.256973
H 3.955544 0.638549 1.723104
H 3.607918 -1.162506 -0.768481
H 2.082064 2.905292 -2.003544
H 4.325511 3.545141 -0.101405
H 6.135609 0.702136 0.749115
H -2.456620 1.520264 -1.326363
H -3.289233 -1.185633 -2.259197
H 0.477965 -2.376132 -0.414935
H 3.085886 -3.901711 1.286552
H -4.463393 -3.081171 -1.098268
H -0.678200 -4.279494 0.726488
H -1.223783 1.884623 4.376950
H 0.446334 2.006555 3.707110
H -0.618448 3.451673 3.800390
H -2.778907 -5.503812 1.139692
H -4.290869 -5.023125 0.419127
H -6.078282 2.905021 1.083277
H -4.707357 3.757148 1.918863
H -5.114691 2.071421 2.380467


