%chk=000227115.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227115

0 1
 S    1.108500       1.369000      0.1164000    
 O    1.257900       2.147800      -1.096300    
 O    1.301300       1.951900       1.428600    
 O    5.719500     -0.6840000     -0.4011000    
 O    4.271600      -2.067000      0.6625000    
 O   -5.027000      -1.010100       1.076700    
 O   -5.043300     -0.8366000      -1.115900    
 N   -4.469900     -0.7132000     -7.1000000E-03
 C    2.091900     -9.9500000E-02 -7.6000001E-03
 C    3.585100      0.2154000      0.1149000    
 C  -0.5691000      0.7430000      7.9000004E-02
 C    1.727800     -0.9055000      -1.247300    
 C   -1.171500      0.4191000       1.269600    
 C   -1.189300      0.6101000      -1.138700    
 C    4.520200     -0.9761000      0.1713000    
 C   -2.477900     -6.8899997E-02   1.240700    
 C   -2.495700      0.1220000      -1.167700    
 C   -3.139900     -0.2175000      2.2000000E-02
 H    1.819700     -0.7045000      0.8679000    
 H    3.777500      0.8073000       1.017700    
 H    3.877700      0.8375000     -0.7410000    
 H    2.395100      -1.764800      -1.369600    
 H   0.7169000      -1.316800      -1.187600    
 H    1.801000     -0.3019000      -2.157900    
 H  -0.6672000      0.5206000       2.224700    
 H  -0.7038000      0.8651000      -2.074600    
 H   -2.947200     -0.3249000       2.187200    
 H   -2.979700      1.8800000E-02  -2.135500    
 H    6.335000      -1.447100     -0.3677000    


%chk=000227115-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000227115

0 1
S 1.093401 1.343776 -0.279010
O 1.112672 2.145397 -1.706505
O 1.509907 2.064839 1.135949
O 5.754636 -0.717081 0.747051
O 3.965266 -2.199220 0.776523
O -5.033040 -1.023109 1.612769
O -5.395145 -0.763109 -0.624650
N -4.651229 -0.695133 0.426019
C 2.248916 -0.279547 -0.443005
C 3.621398 0.151952 0.078183
C -0.673639 0.677565 -0.058289
C 2.181308 -0.755100 -1.887450
C -1.100845 0.339250 1.236956
C -1.493624 0.618126 -1.197198
C 4.413955 -1.052294 0.555236
C -2.425107 -0.119579 1.398225
C -2.818453 0.160784 -1.036380
C -3.252216 -0.206516 0.256339
H 1.759979 -0.972367 0.263787
H 3.502375 0.846381 0.938426
H 4.203310 0.695509 -0.686270
H 2.861236 -1.619304 -2.007013
H 1.167113 -1.088724 -2.168105
H 2.493081 0.042853 -2.583583
H -0.429629 0.461627 2.093135
H -1.108781 0.950419 -2.167066
H -2.823283 -0.400260 2.376515
H -3.511048 0.089743 -1.878774
H 6.252687 -1.507678 1.091786


