%chk=000030783.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000030783

0 1
 I   0.1826000      -2.543000     -7.4400000E-02
 I   -3.658000       2.203700      0.1899000    
 I    2.198400       3.238200     -0.1328000    
 O    4.939200     -0.7882000     -0.5253000    
 O    2.683500     -5.5900000E-02   2.145000    
 O   -4.817700      -1.159200     -0.8658000    
 O   -3.176700     -0.3824000      -2.221500    
 N    2.248300     -4.0700000E-02 -0.1683000    
 C   -2.640200     -0.9252000      0.1030000    
 C   -1.467200      4.2399999E-02  4.5299999E-02
 C   0.8917000      0.4458000     -8.5600004E-02
 C    2.891900     -7.4900001E-02  -1.487900    
 C   -3.498200     -0.7990000       1.378100    
 C  -0.1763000     -0.4498000     -3.3399999E-02
 C    4.012100      -1.092600      -1.555300    
 C    3.011600     -0.3017000      0.9827000    
 C   -1.724000       1.402200      7.3500000E-02
 C   0.6519000       1.819600     -5.8300000E-02
 C    4.349100     -0.9913000      0.7371000    
 C  -0.6560000       2.297900      2.1400001E-02
 C   -3.536500     -0.7827000      -1.122000    
 C   -2.709500      -1.063000       2.654600    
 H   -2.361100      -1.975100      5.7999998E-02
 H    3.313500      0.9143000      -1.684700    
 H    2.140000     -0.2915000      -2.254800    
 H   -4.128900      6.6500001E-02   1.527300    
 H   -4.235000      -1.617400       1.350900    
 H    3.645100      -2.119800      -1.443500    
 H    4.530300      -1.022800      -2.516600    
 H    5.057100     -0.6262000       1.488700    
 H    4.212500      -2.065900      0.9076000    
 H  -0.8432000       3.369600      4.2500000E-02
 H   -2.180300      -2.019700       2.604900    
 H   -1.980500     -0.2699000       2.846300    
 H   -3.387600      -1.104100       3.513700    
 H   -5.390500      -1.066000      -1.656600    


%chk=000030783-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000030783

0 1
I 0.180974 -2.500174 -0.210082
I -3.637611 2.516225 0.064574
I 2.338354 3.238418 -0.026661
O 4.981375 -0.685579 -0.474267
O 2.432882 -0.094465 2.137572
O -4.996606 -1.119398 -0.878141
O -3.357114 -0.245602 -2.261911
N 2.236339 -0.060961 -0.189002
C -2.772743 -0.845562 0.073868
C -1.576895 0.103378 -0.006772
C 0.903444 0.473251 -0.102598
C 2.816064 -0.257605 -1.548737
C -3.473341 -0.865473 1.468150
C -0.236658 -0.377763 -0.087191
C 4.032134 -1.188006 -1.475360
C 2.947362 -0.269139 0.996156
C -1.719120 1.521534 0.029402
C 0.688364 1.871721 -0.041159
C 4.388146 -0.779758 0.863348
C -0.614919 2.397438 0.017608
C -3.699051 -0.657064 -1.131902
C -2.537217 -1.346824 2.596991
H -2.386592 -1.876395 -0.073832
H 3.112307 0.722311 -1.969641
H 2.039496 -0.701372 -2.199830
H -3.868274 0.136277 1.709954
H -4.346857 -1.535492 1.388491
H 3.720912 -2.225049 -1.224875
H 4.573969 -1.189550 -2.434498
H 5.025377 -0.177424 1.529612
H 4.398314 -1.831954 1.223330
H -0.767459 3.477140 0.052993
H -2.183081 -2.378934 2.418494
H -1.646994 -0.700905 2.700568
H -3.072195 -1.336576 3.563331
H -5.531685 -1.038469 -1.714285


