%chk=000038052.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038052

0 1
 S   -3.422100       1.582100     -1.0000000E-03
 O    1.118700      0.5086000      9.9999997E-05
 O    4.534700     -0.2395000      7.9999998E-04
 O    3.460700       1.675000      8.9999998E-04
 N   -2.399800     -0.7922000     -9.9999997E-05
 N    3.446700      0.4086000      7.9999998E-04
 N   -4.762700     -0.7151000      2.7999999E-03
 C   5.0500002E-02 -0.3314000     -7.9999998E-04
 C   -1.355800      0.1121000     -1.2000001E-03
 C   0.4667000      -1.642300     -1.1000000E-03
 C    2.229000     -0.2746000       0.000000    
 C    1.881500      -1.605500     -6.9999998E-04
 C   -1.712600       1.444300     -8.9999998E-04
 C   -3.535500     -0.1302000      3.0000001E-04
 H  -0.1593000      -2.523900     -1.7000000E-03
 H    2.557900      -2.448600     -8.9999998E-04
 H   -1.080800       2.321900     -1.1000000E-03
 H   -4.873900      -1.723700      4.1999999E-03
 H   -5.616400     -0.1666000      3.5999999E-03


%chk=000038052-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000038052

0 1
S -3.462865 1.717192 0.000456
O 1.060111 0.526802 -0.000408
O 4.542861 -0.328223 -0.000435
O 3.496246 1.722106 -0.000547
N -2.432550 -0.769741 0.000714
N 3.483703 0.428145 -0.001007
N -4.824976 -0.741701 0.001444
C -0.008024 -0.392866 -0.000022
C -1.353995 0.139998 0.000230
C 0.492358 -1.700444 0.000086
C 2.226625 -0.251116 -0.000582
C 1.920228 -1.609121 -0.000286
C -1.681804 1.490353 0.000175
C -3.593763 -0.137379 0.000948
H -0.119554 -2.598406 0.000388
H 2.646235 -2.417555 -0.000331
H -1.013414 2.347646 -0.000091
H -4.861502 -1.758873 0.001686
H -5.688421 -0.207819 0.001581


