%chk=000133223.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133223

0 1
 S    2.707100       3.267700      0.6114000    
 S    4.455200      -1.344600      0.3556000    
 O   0.7891000       1.392900      0.1912000    
 O    1.747800      -1.327000      0.1540000    
 O    4.172500       2.561100      0.4854000    
 O    4.610800     -0.4218000     -0.9811000    
 O    2.236800       3.129500       1.977700    
 O    2.726400       4.545900     -7.5900003E-02
 O    5.442900      -2.407300      0.3084000    
 O    4.292000     -0.4894000       1.516800    
 N   -2.066200      0.3071000     -0.3480000    
 N   -1.600300      -2.340700      0.3144000    
 N   -2.852000      -1.840000      0.3707000    
 N   -5.302600     -0.9276000      0.4986000    
 C  -0.8339000     -0.2212000     -0.3936000    
 C  -0.5955000      -1.531500     -6.7100003E-02
 C   0.1926000      0.6985000     -0.8106000    
 C   0.7007000      -2.154200     -9.6900001E-02
 C    1.715200       2.195700     -0.3953000    
 C   0.7227000       1.044400      -2.028200    
 C    2.869300      -2.090800      8.1699997E-02
 C    1.137300      -3.435800     -0.3283000    
 C    1.713500       2.018700      -1.759400    
 C    2.547300      -3.395400     -0.2125000    
 C   -3.021500     -0.5477000      3.8400002E-02
 C   -4.368600     -3.3100002E-02  0.1047000    
 C   -4.645000       1.285400     -0.2190000    
 C   -5.965000       1.713600     -0.1327000    
 C   -6.574600     -0.4752000      0.5706000    
 C   -6.954200      0.8227000      0.2690000    
 H   0.4372000      0.6480000      -2.992400    
 H   0.5241000      -4.296800     -0.5543000    
 H    2.346900       2.525500      -2.473200    
 H    3.237800      -4.218100     -0.3307000    
 H   -3.884600       1.992400     -0.5338000    
 H   -6.222900       2.739500     -0.3778000    
 H    4.573000       2.570900     -0.4157000    
 H    3.958300      0.3116000      -1.068800    
 H   -7.308000      -1.208800      0.8886000    
 H   -7.989700       1.134600      0.3433000    


%chk=000133223-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133223

0 1
S 3.677858 2.919235 0.129126
S 4.557844 -1.747163 -0.641272
O 1.366851 1.381253 0.269352
O 1.893429 -1.244346 -0.088843
O 4.464373 1.430130 -0.636282
O 4.121327 -0.728398 -2.067853
O 3.948199 2.836152 1.716757
O 4.050786 4.213761 -0.751682
O 5.292774 -3.095972 -1.104501
O 5.290994 -0.776640 0.467944
N -2.144349 0.471723 -0.138492
N -1.476767 -1.796693 1.282015
N -2.772722 -1.435913 1.212388
N -5.333519 -1.264012 0.089379
C -0.817868 0.204338 0.074801
C -0.478748 -1.080905 0.624618
C 0.072647 1.297896 -0.290637
C 0.781508 -1.801291 0.584382
C 1.933878 2.519740 -0.292843
C -0.130985 2.377119 -1.156290
C 2.892170 -2.209566 -0.011188
C 1.115889 -3.076150 1.054647
C 1.074211 3.160446 -1.167808
C 2.476519 -3.339459 0.672203
C -3.079289 -0.390419 0.329680
C -4.501363 -0.181368 -0.032879
C -4.945159 1.089532 -0.484433
C -6.307557 1.251475 -0.812267
C -6.643546 -1.087541 -0.232447
C -7.178129 0.145114 -0.681590
H -1.038852 2.558207 -1.725728
H 0.443976 -3.730777 1.604001
H 1.292413 4.058686 -1.740007
H 3.068403 -4.229533 0.870805
H -4.230979 1.913525 -0.560270
H -6.683512 2.219980 -1.157113
H 4.952161 0.856918 0.064557
H 4.191056 0.254372 -1.734678
H -7.281793 -1.972056 -0.128864
H -8.242230 0.227303 -0.923490


