%chk=000150387.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150387

0 1
 S   -4.000400      -2.062800      1.9999999E-04
 O   5.2400000E-02   2.458900     -1.5000000E-03
 O   -2.111400       2.829700     -1.7000000E-03
 O    5.723800     -0.1457000       1.095900    
 O    5.722600     -0.1514000      -1.099300    
 N   -2.617900      9.7099997E-02  6.0000003E-04
 N   -1.219000      -1.644300      2.4000001E-03
 N   -1.135600       2.025300     -5.0000002E-04
 N    5.115900     -0.1781000     -1.3000000E-03
 C   -1.372100      0.6453000      1.4000000E-03
 C  -0.5232000     -0.4495000      2.6000000E-03
 C   -2.463700      -1.255300      1.5000000E-03
 C   0.9077000     -0.3813000      1.6000000E-03
 C   -3.915900      0.5502000     -7.9999998E-04
 C   -4.797400     -0.4676000     -1.1000000E-03
 C    1.608300     -0.3459000       1.209100    
 C    1.607100     -0.3497000      -1.206800    
 C   -6.280900     -0.3649000     -2.4999999E-03
 C    3.001600     -0.2792000       1.208200    
 C    3.000400     -0.2831000      -1.207700    
 C    3.697700     -0.2478000     -1.9999999E-04
 H   -4.171500       1.597900     -1.4000000E-03
 H    1.080600     -0.3695000       2.159900    
 H    1.078300     -0.3765000      -2.156900    
 H   -6.608900      0.6800000     -3.4000000E-03
 H   -6.702700     -0.8459000      0.8859000    
 H   -6.701000     -0.8467000     -0.8913000    
 H    3.511400     -0.2529000       2.167900    
 H    3.509200     -0.2599000      -2.168100    


%chk=000150387-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000150387

0 1
S -4.056895 -2.102037 -0.002486
O 0.013894 2.567330 0.008332
O -2.260451 2.901712 0.007912
O 5.874480 -0.268096 1.140465
O 5.875016 -0.278401 -1.140239
N -2.705555 0.157261 -0.001088
N -1.198444 -1.575931 -0.002015
N -1.204610 2.131995 -0.000398
N 5.269460 -0.280195 0.000003
C -1.417889 0.724221 -0.000822
C -0.503900 -0.364862 -0.001064
C -2.503707 -1.224201 -0.001866
C 0.982198 -0.321840 -0.000810
C -4.050536 0.576588 -0.000920
C -4.933579 -0.475967 -0.001472
C 1.694201 -0.311595 1.225361
C 1.694764 -0.322439 -1.226692
C -6.431476 -0.439231 -0.001475
C 3.101650 -0.297051 1.234789
C 3.102230 -0.307872 -1.235593
C 3.783911 -0.294845 -0.000279
H -4.280887 1.638852 -0.000428
H 1.143940 -0.314321 2.171231
H 1.144905 -0.333626 -2.172732
H -6.779518 0.607580 -0.000899
H -6.852668 -0.937380 0.890700
H -6.852629 -0.936384 -0.894222
H 3.673241 -0.286937 2.166135
H 3.674253 -0.305929 -2.166728


