%chk=000004019.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004019

0 1
 S   -2.378200      -1.589500      -1.454800    
 S   -4.597700       1.401500     -0.1669000    
 O  -0.2277000     -0.1439000      2.8200001E-02
 O  -0.5181000      9.0700001E-02   2.297300    
 O   -2.999600     -1.4500000E-02   2.175200    
 N    3.636600       1.318900     -0.5787000    
 C    3.391600     -3.3700000E-02  -1.117900    
 C    4.312200      -1.044300     -0.3428000    
 C    3.137300       1.417400      0.8003000    
 C    4.123500     -0.9389000       1.190600    
 C    1.881200     -0.3608000      -1.129800    
 C    4.001500      0.5031000       1.688800    
 C    1.628300       1.128900      0.9078000    
 C    1.186900     -0.1608000      0.2161000    
 C    4.048200      -2.498400     -0.7798000    
 C    5.795300     -0.7345000     -0.6788000    
 C    3.162300       2.392500      -1.444900    
 C  -0.9806000     -1.0800000E-02   1.167300    
 C   -2.473900     -4.9100000E-02  0.8327000    
 C   -2.920000      -1.329500      0.1223000    
 C   -2.939300       1.190700      6.5899998E-02
 C   -3.714100      -2.294200      0.6235000    
 C   -2.158900       2.155000     -0.4575000    
 C   -3.903900      -3.328700     -0.3379000    
 C   -2.957700       3.145600      -1.098200    
 C   -3.232800      -3.072100      -1.513100    
 C   -4.302500       2.859400      -1.014900    
 H    3.723000     -5.5000000E-02  -2.166000    
 H    3.303500       2.439200       1.168100    
 H    4.962500      -1.421500       1.709700    
 H    3.245400      -1.505700       1.512300    
 H    1.381600      0.2708000      -1.877200    
 H    1.696800      -1.379100      -1.490100    
 H    3.618700      0.5015000       2.716600    
 H    5.011300      0.9319000       1.746300    
 H    1.387200       1.130700       1.974000    
 H    1.073400       1.976400      0.4861000    
 H    1.403200      -1.024900      0.8491000    
 H    4.773900      -3.183900     -0.3269000    
 H    3.054300      -2.842300     -0.4757000    
 H    4.125100      -2.603300      -1.867700    
 H    6.092600      0.2706000     -0.3631000    
 H    6.468800      -1.442700     -0.1819000    
 H    5.976700     -0.8113000      -1.757100    
 H    3.619000       2.311200      -2.437500    
 H    3.468000       3.365200      -1.043500    
 H    2.075800       2.408800      -1.572000    
 H   -2.702800     -0.8120000       2.647300    
 H   -4.157800      -2.300700       1.610300    
 H   -1.081300       2.208600     -0.4146000    
 H   -4.503000      -4.215400     -0.1760000    
 H   -2.566000       4.024200      -1.594300    
 H   -3.203600      -3.684400      -2.403400    
 H   -5.125800       3.436900      -1.411200    


%chk=000004019-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000004019

0 1
S -2.773806 -1.105272 -1.935925
S -4.666466 1.796359 0.888812
O -0.281062 -0.001679 0.126341
O -0.716768 -0.284757 2.399578
O -3.337145 -0.523397 2.071577
N 3.676981 1.219610 -0.750993
C 3.378682 -0.209286 -1.046170
C 4.300394 -1.120461 -0.154832
C 3.240055 1.566109 0.626704
C 4.132985 -0.754411 1.353704
C 1.836039 -0.482285 -0.958116
C 4.120707 0.771674 1.624455
C 1.693135 1.367405 0.815209
C 1.229486 -0.031278 0.375887
C 3.964842 -2.618534 -0.362578
C 5.771107 -0.879817 -0.594800
C 3.284923 2.178757 -1.798059
C -1.097661 -0.158763 1.206150
C -2.622183 -0.197185 0.836414
C -2.901204 -1.327203 -0.147600
C -3.061610 1.175593 0.338459
C -3.261993 -2.627071 0.171287
C -2.463955 2.049384 -0.558631
C -3.435819 -3.478808 -0.980382
C -3.254705 3.225186 -0.832346
C -3.208820 -2.828614 -2.182529
C -4.456808 3.246774 -0.143835
H 3.673515 -0.397883 -2.098328
H 3.444926 2.643668 0.780386
H 4.960366 -1.219321 1.925273
H 3.206816 -1.215143 1.746138
H 1.345405 0.093924 -1.766469
H 1.602882 -1.544432 -1.144563
H 3.783918 0.967364 2.661038
H 5.149733 1.167232 1.534200
H 1.403716 1.555454 1.864391
H 1.171690 2.116234 0.186924
H 1.372605 -0.770802 1.180331
H 4.697128 -3.249652 0.175381
H 2.960853 -2.882582 0.017950
H 4.009639 -2.894621 -1.433911
H 6.019610 0.193659 -0.554772
H 6.468726 -1.436455 0.058963
H 5.931547 -1.228229 -1.633584
H 3.744389 1.878454 -2.757248
H 3.672263 3.180647 -1.537048
H 2.184571 2.277666 -1.967472
H -2.683313 -0.405709 2.820246
H -3.423808 -2.938756 1.204289
H -1.491562 1.850518 -1.013454
H -3.727524 -4.529981 -0.916342
H -2.937306 4.021412 -1.510232
H -3.273916 -3.214466 -3.198599
H -5.235798 4.007569 -0.149665


