%chk=000038376.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000038376

0 1
 O   -1.106900      -2.292600      0.3262000    
 O   -1.130400       2.303900     -0.3217000    
 O    5.599600      -1.117800     -0.4719000    
 O    5.782300      0.9691000      0.4101000    
 N  -0.6089000      8.3999997E-03  3.1999999E-03
 C   -2.790400     -0.6649000      7.3799998E-02
 C   -2.797200      0.6583000     -7.4699998E-02
 C   -4.005400      -1.511000      0.1876000    
 C   -4.020900       1.491200     -0.1931000    
 C   -5.258200     -0.6518000      0.4263000    
 C   -5.263600      0.6185000     -0.4361000    
 C   -1.396500      -1.121900      0.1414000    
 C   -1.408200       1.130300     -0.1375000    
 C   0.8235000      1.6100001E-02  5.2999998E-03
 C    1.518500       1.132400      0.4774000    
 C    1.532500      -1.092800     -0.4635000    
 C    2.913300       1.140000      0.4804000    
 C    2.927300      -1.085200     -0.4604000    
 C    3.617700      3.1199999E-02  1.1600000E-02
 C    5.072100      3.8400002E-02  1.5699999E-02
 H   -4.126600      -2.084800     -0.7387000    
 H   -3.900700      -2.230400       1.007300    
 H   -4.151600       2.063800      0.7327000    
 H   -3.921100       2.211500      -1.012600    
 H   -6.155000      -1.247200      0.2205000    
 H   -5.304800     -0.3640000       1.484600    
 H   -6.167500       1.204200     -0.2333000    
 H   -5.303400      0.3302000      -1.494600    
 H    1.003700       2.001300      0.8760000    
 H    1.028300      -1.967100     -0.8639000    
 H    3.432800       2.016800      0.8581000    
 H    3.436200      -1.966800     -0.8399000    
 H    6.580500      -1.103100     -0.4645000    


%chk=000038376-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000038376

0 1
O -1.043523 -2.350557 0.266280
O -1.051977 2.349028 -0.271224
O 5.743126 -1.125810 -0.465596
O 5.855667 1.017758 0.418744
N -0.594369 0.000091 -0.001758
C -2.853956 -0.682309 0.074376
C -2.856398 0.674789 -0.076098
C -4.082796 -1.537319 0.184470
C -4.088209 1.525627 -0.184940
C -5.323215 -0.640753 0.449246
C -5.325838 0.624901 -0.448475
C -1.436683 -1.167125 0.128685
C -1.440882 1.164518 -0.132002
C 0.838779 0.002692 -0.001502
C 1.548227 1.139577 0.473555
C 1.552197 -1.131349 -0.475615
C 2.952791 1.136446 0.467243
C 2.957877 -1.126924 -0.468486
C 3.670962 0.005814 -0.000119
C 5.153997 0.054607 0.021225
H -4.213289 -2.116157 -0.753079
H -3.952779 -2.293079 0.982261
H -4.219648 2.103949 0.752789
H -3.961514 2.281933 -0.982746
H -6.246353 -1.224649 0.280961
H -5.326066 -0.330185 1.512726
H -6.250764 1.205671 -0.279211
H -5.328759 0.314355 -1.511967
H 1.003538 2.016608 0.826554
H 1.009716 -2.009604 -0.829099
H 3.514978 2.003433 0.828649
H 3.514127 -1.995749 -0.830195
H 6.732035 -1.026029 -0.423849


