%chk=000077703.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077703

0 1
 S    1.401400      6.6000000E-03 -0.6058000    
 O    1.725600      -1.246700      -1.283200    
 O    1.679500       1.272000      -1.278900    
 O    4.441500     -4.9000001E-03  0.8903000    
 N    2.091600     -6.3999998E-03  0.8852000    
 C  -0.3124000      2.4999999E-03 -0.2722000    
 C   -3.050800     -4.6000001E-03  0.2601000    
 C  -0.9980000       1.208600     -0.1281000    
 C  -0.9959000      -1.207200     -0.1502000    
 C   -2.367300       1.205100      0.1382000    
 C   -2.365200      -1.210800      0.1159000    
 C   -4.515000     -8.6000003E-03  0.5434000    
 C    3.265200     -5.7000001E-03  0.8853000    
 H  -0.4860000       2.163100     -0.2108000    
 H  -0.4812000      -2.158400     -0.2519000    
 H   -2.890500       2.151300      0.2483000    
 H   -2.887000      -2.159700      0.2083000    
 H   -4.803300     -0.8935000       1.121100    
 H   -4.805900      0.8673000       1.133200    
 H   -5.079000     -2.9000000E-03 -0.3946000    


%chk=000077703-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000077703

0 1
S 1.412257 0.010024 -0.892472
O 1.797657 -1.392865 -1.600079
O 1.793666 1.424602 -1.578642
O 4.562397 -0.010986 1.499512
N 2.168116 -0.002488 0.920920
C -0.389204 0.003616 -0.388890
C -3.093037 -0.005726 0.306569
C -1.027043 1.241177 -0.214781
C -1.023340 -1.238328 -0.233579
C -2.394151 1.219616 0.135599
C -2.390510 -1.226249 0.117033
C -4.568977 -0.010445 0.654834
C 3.403867 -0.006511 1.138143
H -0.483693 2.180316 -0.357610
H -0.477194 -2.173572 -0.390605
H -2.922485 2.168560 0.279666
H -2.915990 -2.178852 0.246619
H -4.848047 -0.909043 1.231227
H -4.850543 0.878802 1.244367
H -5.186445 -0.004547 -0.264231


