%chk=000102172.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102172

0 1
 S    5.924200       1.890100     -0.2064000    
 O    2.150700      -1.135600      -1.867000    
 O  -0.6647000       1.353300       1.750200    
 O    4.191900      -2.065100      0.5117000    
 O    5.246100      0.3993000     -0.1334000    
 O   -6.981400       1.647300      -1.380500    
 O    7.491600       1.579200     -0.5350000    
 O    5.364600       2.576500      -1.356000    
 O    5.856100       2.497600       1.109600    
 C   0.9266000     -0.8439000      0.2453000    
 C  -0.2475000      -1.699600     -0.2778000    
 C   -1.606300      -1.314300      0.3263000    
 C   -1.908200      0.1791000     -2.3700001E-02
 C    2.100300      -1.536300     -0.5010000    
 C   0.6438000      0.6200000     -0.1499000    
 C   -3.340500      0.6487000      0.4617000    
 C  -0.7270000       1.128600      0.3489000    
 C   0.2551000      -3.131000     -0.1094000    
 C    1.763300      -3.043100     -0.4235000    
 C   -2.713600      -2.226300     -0.2249000    
 C    1.140400     -0.9683000       1.779300    
 C   -4.389400     -0.3708000     -3.3000000E-03
 C   -4.087600      -1.820700      0.2865000    
 C   -3.632500       2.039500     -0.1734000    
 C   -3.466400      0.7625000       1.997800    
 C    3.453100      -1.196300      5.0600000E-02
 C   -5.099900       2.434200     -0.1253000    
 C   -5.545100     -4.2199999E-02 -0.6045000    
 C   -5.945200       1.373000     -0.7788000    
 C    3.847600      0.2645000      5.7999999E-03
 H  -0.3384000      -1.537800      -1.364900    
 H   -1.580400      -1.442900       1.413000    
 H   -1.946000      0.2083000      -1.126000    
 H   0.6585000      0.7266000      -1.241400    
 H    1.418800       1.281800      0.2470000    
 H  -0.9001000       2.106600     -0.1143000    
 H  -0.2485000      -3.826300     -0.7889000    
 H   9.6500002E-02  -3.493100      0.9127000    
 H    2.311800      -3.574500      0.3615000    
 H    1.973800      -3.551000      -1.371800    
 H   -2.524600      -3.265800      6.7599997E-02
 H   -2.710400      -2.201000      -1.322600    
 H    1.860200     -0.2275000       2.141600    
 H   0.2229000     -0.8202000       2.352200    
 H    1.522500      -1.952500       2.070700    
 H   -4.141100      -1.987900       1.369300    
 H   -4.839100      -2.481800     -0.1625000    
 H   -3.319000       2.034200      -1.226900    
 H   -3.043100       2.821400      0.3204000    
 H   -3.038600     -0.1025000       2.514100    
 H   -2.973000       1.660000       2.383500    
 H   -4.515300      0.8329000       2.311400    
 H    2.798100      -1.698100      -2.325700    
 H   -5.237600       3.374100     -0.6711000    
 H   -5.449300       2.581400      0.9015000    
 H   4.8599999E-02   1.992400       1.917700    
 H   -6.257400     -0.7935000     -0.9283000    
 H    3.533000      0.7470000      0.9344000    
 H    3.379000      0.7570000     -0.8494000    
 H    7.908500      0.8808000      2.2299999E-02


%chk=000102172-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000102172

0 1
S 5.311954 1.719753 0.746150
O 1.908389 -0.994521 -2.285729
O -0.560494 1.518099 1.651689
O 4.233983 -1.285001 0.442097
O 5.377757 0.859612 -0.946163
O -7.088884 1.599445 -1.051677
O 5.897299 0.353312 1.720602
O 6.416865 2.863489 0.770998
O 3.750874 2.032846 1.040307
C 1.041173 -0.674974 0.025286
C -0.128894 -1.646170 -0.327292
C -1.451909 -1.301821 0.389431
C -1.855567 0.161783 0.024307
C 2.181611 -1.354000 -0.871901
C 0.639996 0.751326 -0.406773
C -3.255997 0.607088 0.624616
C -0.713486 1.201849 0.211760
C 0.487837 -3.056041 -0.156347
C 1.978302 -2.877642 -0.607224
C -2.560010 -2.279597 -0.076624
C 1.448323 -0.732195 1.521197
C -4.301379 -0.429524 0.173643
C -3.965559 -1.885763 0.435342
C -3.609303 2.016627 0.056034
C -3.284930 0.644302 2.187633
C 3.566684 -0.822628 -0.531280
C -5.105330 2.376699 0.163796
C -5.507788 -0.078774 -0.377094
C -5.984841 1.314593 -0.493161
C 4.077680 0.354587 -1.372930
H -0.319430 -1.501677 -1.413620
H -1.324294 -1.394836 1.486124
H -2.015783 0.150927 -1.080333
H 0.546728 0.777728 -1.509042
H 1.413187 1.494136 -0.117975
H -1.009890 2.135757 -0.311218
H -0.035858 -3.815657 -0.761447
H 0.437969 -3.382988 0.898325
H 2.685138 -3.213516 0.169882
H 2.211640 -3.460086 -1.520690
H -2.324250 -3.307837 0.258197
H -2.571734 -2.295138 -1.186796
H 2.212672 0.032169 1.748101
H 0.576660 -0.516432 2.157028
H 1.865549 -1.711501 1.809573
H -4.002733 -2.061419 1.530989
H -4.735392 -2.539706 -0.013602
H -3.322747 2.052526 -1.015733
H -3.005956 2.779262 0.581747
H -3.006560 -0.327602 2.630852
H -2.572284 1.394278 2.559742
H -4.302580 0.889593 2.542666
H 2.042899 -1.795694 -2.851206
H -5.321466 3.355046 -0.300359
H -5.410126 2.454647 1.227519
H 0.274722 2.039001 1.769435
H -6.213310 -0.851273 -0.710947
H 3.304430 1.146015 -1.408275
H 4.246229 0.026997 -2.415597
H 5.402614 -0.461478 1.312968


