%chk=000017405.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017405

0 1
 S  -0.9095000     -0.9799000      3.8000001E-03
 O    2.101500     -0.4222000      2.7999999E-03
 O   -5.278800      0.7374000     -2.0000001E-03
 O    5.595200     -0.5751000     -5.5999998E-03
 O    4.066200      -2.150200      2.7000001E-03
 N   -3.537500     -0.8618000      8.9999998E-04
 N  -0.9370000       1.582200      1.9000000E-03
 N   -2.265600       1.194400      8.9999998E-04
 N    4.377300     -0.9226000     -1.2000001E-03
 C    1.284500      0.6638000      1.9000000E-03
 C  -0.1301000      0.5456000      3.7000000E-03
 C    2.023100       1.824100     -1.7000000E-03
 C    3.375500      4.9899999E-02 -1.9999999E-04
 C    3.381000       1.425400     -3.1000001E-03
 C   -2.391200     -0.1155000      1.6000000E-03
 C   -4.886900     -0.4250000     -6.9999998E-04
 C   -5.867700      -1.570500     -5.5999998E-03
 H    1.643200       2.836400     -3.4000000E-03
 H    4.251100       2.066800     -6.0999999E-03
 H   -3.380200      -1.866800      3.0000001E-04
 H   -5.798100      -2.106100     -0.9563000    
 H   -6.884900      -1.189100      0.1186000    
 H   -5.644600      -2.256100      0.8167000    


%chk=000017405-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000017405

0 1
S -0.837469 -1.172490 0.009812
O 2.149831 -0.421515 0.003344
O -5.223701 0.796714 0.018746
O 5.733824 -0.385482 -0.001571
O 4.247761 -2.144616 0.008710
N -3.632394 -0.949372 0.010777
N -0.986706 1.509838 -0.002166
N -2.313845 1.096816 0.000607
N 4.533835 -0.884442 0.002305
C 1.323270 0.719920 -0.001116
C -0.098369 0.506694 0.001632
C 2.109409 1.880356 -0.007867
C 3.461894 0.068472 -0.000820
C 3.476882 1.461155 -0.007599
C -2.442199 -0.235625 0.006602
C -4.967950 -0.424286 0.011440
C -6.017803 -1.531729 -0.009919
H 1.721436 2.895895 -0.012363
H 4.368674 2.082129 -0.011831
H -3.553178 -1.968871 0.010250
H -5.996808 -2.074303 -0.973464
H -7.010377 -1.075806 0.111635
H -5.859516 -2.264351 0.802755


