%chk=000088225.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088225

0 1
 S   7.2099999E-02   2.597900     -0.1047000    
 O  -0.8681000       3.510700      0.5205000    
 O    1.224800       3.137400     -0.8043000    
 O    4.960900      -2.895500     -0.4453000    
 O   -5.012100      -2.910000      0.2049000    
 O    6.251500      -1.130200     -0.2523000    
 O   -6.138700      -1.121800      0.7980000    
 N   0.6259000       1.470600       1.089400    
 N  -0.7603000       1.580700      -1.197200    
 N    5.121400      -1.673700     -0.2087000    
 N   -5.106700      -1.665800      0.3360000    
 C    1.764400      0.6742000      0.7606000    
 C   -1.873300      0.7492000     -0.8045000    
 C    1.610300     -0.6860000      0.4934000    
 C   -1.778600     -0.6273000     -0.9452000    
 C    3.030700       1.256600      0.7065000    
 C   -3.018700       1.341000     -0.2932000    
 C    3.989000     -0.8816000      0.1181000    
 C   -4.011800     -0.8480000     -5.0000001E-02
 C    2.722700      -1.464000      0.1722000    
 C   -2.854100      -1.430500     -0.5658000    
 C    4.142900      0.4786000      0.3852000    
 C   -4.094100      0.5376000      8.6400002E-02
 H  -0.1131000      0.9742000       1.604600    
 H  -0.1455000       1.103400      -1.871300    
 H   0.6348000      -1.157900      0.5541000    
 H  -0.8875000      -1.090300      -1.358500    
 H    3.169200       2.312000      0.9266000    
 H   -3.109200       2.418500     -0.1983000    
 H    2.565500      -2.521400     -2.5100000E-02
 H   -2.755400      -2.506100     -0.6890000    
 H    5.114300      0.9656000      0.3556000    
 H   -4.981600       1.026300      0.4801000    


%chk=000088225-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000088225

0 1
S 0.003290 2.797955 0.094088
O -1.080704 3.527116 1.037800
O 1.092791 3.582840 -0.796222
O 4.971321 -3.173217 0.307676
O -5.047558 -3.073926 -0.550580
O 5.957793 -1.559691 -0.973558
O -6.022313 -1.535708 0.828526
N 1.003991 1.730776 1.382858
N -1.002766 1.832677 -1.263682
N 5.032425 -1.975562 -0.174107
N -5.096148 -1.910536 0.010003
C 1.959308 0.794120 0.949293
C -1.975650 0.884002 -0.901193
C 1.921762 -0.553833 1.424381
C -1.953490 -0.428795 -1.467085
C 3.019369 1.214703 0.087480
C -3.035659 1.260082 -0.019129
C 3.970501 -1.019210 0.213190
C -4.017632 -0.945798 -0.304249
C 2.939412 -1.455219 1.076665
C -2.986150 -1.337046 -1.188494
C 4.017227 0.303090 -0.288781
C -4.049542 0.339697 0.286497
H 0.301080 1.393802 2.063666
H -0.304477 1.535935 -1.967176
H 1.102964 -0.879868 2.076520
H -1.134460 -0.721589 -2.134418
H 3.050251 2.252370 -0.256143
H -3.053934 2.271741 0.395465
H 2.944214 -2.485861 1.440691
H -3.002411 -2.340403 -1.621814
H 4.840706 0.598260 -0.944231
H -4.873914 0.601494 0.954863


