%chk=000024916.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000024916

0 1
 O    2.188700     -0.5760000      0.1605000    
 O    3.539400     -0.5655000      -1.703400    
 C  -3.0400001E-02  -1.564200      0.3429000    
 C  -0.6270000     -0.2722000      0.9475000    
 C   -1.097500      -2.342200     -0.4660000    
 C   -1.149300      0.7662000     -5.5399999E-02
 C    1.189100      -1.289600     -0.5536000    
 C   -2.322300      -2.747600      0.3609000    
 C   -1.785300       1.988400      0.6119000    
 C   -2.394600       2.977100     -0.3876000    
 C   -3.299300      -3.581300     -0.4702000    
 C   -3.056900       4.185100      0.2761000    
 C   -4.532100      -3.960600      0.3346000    
 C   -3.577900       5.169700     -0.7600000    
 C    3.324100     -0.2736000     -0.5355000    
 C    4.274300      0.4693000      0.3386000    
 C    3.912100      0.7772000       1.759200    
 C    5.445000      0.8399000     -0.2004000    
 H   0.3024000      -2.186500       1.184400    
 H   0.1451000      0.2101000       1.561900    
 H   -1.424300     -0.5278000       1.654500    
 H  -0.6302000      -3.255000     -0.8590000    
 H   -1.414300      -1.765800      -1.343100    
 H   -1.900100      0.3057000     -0.7063000    
 H  -0.3306000       1.105000     -0.7001000    
 H    1.610100      -2.245600     -0.8893000    
 H   0.8945000     -0.7180000      -1.441700    
 H   -2.002400      -3.318800       1.240400    
 H   -2.851100      -1.858700      0.7201000    
 H   -1.029400       2.503100       1.217600    
 H   -2.570000       1.653500       1.301600    
 H   -3.136200       2.454700      -1.004800    
 H   -1.605900       3.323400      -1.067200    
 H   -3.609600      -3.016900      -1.357300    
 H   -2.804100      -4.493700     -0.8224000    
 H   -3.885500       3.851500      0.9112000    
 H   -2.334600       4.694500      0.9243000    
 H   -5.215300      -4.558000     -0.2773000    
 H   -5.070200      -3.069100      0.6722000    
 H   -4.259300      -4.551500       1.214700    
 H   -4.049800       6.024800     -0.2659000    
 H   -4.322900       4.698400      -1.409100    
 H   -2.763900       5.546900      -1.387500    
 H    3.006400       1.391300       1.800300    
 H    3.735400     -0.1468000       2.319600    
 H    4.706700       1.327800       2.274200    
 H    6.179600       1.383900      0.3853000    
 H    5.712500      0.6196000      -1.228500    


%chk=000024916-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000024916

0 1
O 2.226216 -0.607083 0.192309
O 3.525468 -0.417694 -1.733168
C -0.047656 -1.510158 0.287973
C -0.620549 -0.190426 0.877768
C -1.090194 -2.361809 -0.490935
C -1.255809 0.788872 -0.137597
C 1.163743 -1.265014 -0.623887
C -2.335203 -2.753971 0.335636
C -1.814108 2.058325 0.546063
C -2.458302 3.056239 -0.442534
C -3.272188 -3.726894 -0.417070
C -3.043837 4.308743 0.249094
C -4.531805 -4.096344 0.395508
C -3.687187 5.301148 -0.743615
C 3.380863 -0.225748 -0.499164
C 4.376081 0.420380 0.422531
C 4.030652 0.561187 1.890595
C 5.546555 0.846880 -0.127059
H 0.309357 -2.120746 1.144756
H 0.198335 0.328686 1.413686
H -1.378137 -0.446487 1.645058
H -0.594700 -3.290577 -0.844522
H -1.414104 -1.820702 -1.403768
H -2.078738 0.288017 -0.687370
H -0.507759 1.090724 -0.899003
H 1.574861 -2.211622 -1.022316
H 0.927366 -0.610342 -1.482774
H -2.012834 -3.221833 1.289616
H -2.908489 -1.846037 0.611369
H -0.996647 2.565925 1.099910
H -2.565599 1.760691 1.307698
H -3.263060 2.543188 -1.010102
H -1.702702 3.371424 -1.192335
H -3.573417 -3.269063 -1.381637
H -2.711154 -4.648740 -0.673481
H -3.798471 3.990658 0.997558
H -2.240070 4.820400 0.817119
H -5.183925 -4.793717 -0.161727
H -5.127166 -3.195009 0.635095
H -4.258376 -4.580569 1.352131
H -4.103730 6.183440 -0.223478
H -4.509860 4.820547 -1.306344
H -2.944743 5.662252 -1.480202
H 3.111878 1.160065 2.025625
H 3.830093 -0.424934 2.346388
H 4.854246 1.046377 2.441355
H 6.321143 1.327699 0.480069
H 5.736765 0.715751 -1.197922


