%chk=000103826.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000103826

0 1
 O    2.144900     -0.1320000      0.8184000    
 O    2.531700       1.538800     -0.7295000    
 C    1.839500      -1.048400     -0.2418000    
 C   0.6162000     -0.4875000     -0.9953000    
 C  -0.6433000     -0.2840000     -0.1474000    
 C   -1.770700      0.3431000     -0.9796000    
 C   -3.039300      0.6378000     -0.1553000    
 C    3.078800      -1.154300      -1.133100    
 C    1.545300      -2.395800      0.4184000    
 C   -4.074000       1.357900      -1.024100    
 C   -3.649300     -0.6224000      0.4062000    
 C    2.474500       1.128800      0.4220000    
 C   -3.820100     -0.8521000       1.713300    
 C    2.765500       1.970000       1.627700    
 H   0.3654000      -1.206100      -1.789300    
 H   0.8255000      0.4379000      -1.536500    
 H  -0.4227000      0.3684000      0.7049000    
 H  -0.9763000      -1.247000      0.2524000    
 H   -2.014500     -0.3215000      -1.819000    
 H   -1.408400       1.282300      -1.417400    
 H   -2.765400       1.314700      0.6649000    
 H    3.196700     -0.3251000      -1.835500    
 H    3.022300      -2.056200      -1.754300    
 H    3.996300      -1.213700     -0.5364000    
 H   0.7913000      -2.305300       1.207400    
 H    2.443700      -2.787200      0.9107000    
 H    1.205800      -3.136800     -0.3123000    
 H   -4.376400      0.7458000      -1.881500    
 H   -4.974000       1.597200     -0.4466000    
 H   -3.667600       2.299100      -1.409900    
 H   -3.966000      -1.386300     -0.2999000    
 H   -4.265000      -1.780600       2.054000    
 H   -3.521300     -0.1258000       2.460900    
 H    3.607800       1.546700       2.180700    
 H    1.877400       2.027900       2.262000    
 H    3.031800       2.981600       1.308200    


%chk=000103826-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000103826

0 1
O 2.241030 -0.038509 0.780121
O 2.543964 1.753213 -0.709448
C 1.853386 -1.059748 -0.293304
C 0.585198 -0.586570 -1.051536
C -0.644112 -0.274458 -0.169972
C -1.802380 0.328943 -0.994439
C -3.084732 0.624370 -0.161883
C 3.046724 -1.250143 -1.251126
C 1.607884 -2.324180 0.547912
C -4.110817 1.419011 -1.013889
C -3.718043 -0.657491 0.350515
C 2.553182 1.277595 0.451217
C -3.930026 -0.978215 1.651528
C 2.906294 2.048816 1.710206
H 0.324970 -1.390906 -1.770613
H 0.849574 0.305136 -1.648261
H -0.355974 0.438591 0.628471
H -0.999949 -1.189810 0.340345
H -2.065259 -0.358214 -1.827429
H -1.459958 1.272764 -1.466426
H -2.795551 1.245690 0.711144
H 3.225079 -0.343279 -1.850420
H 2.836465 -2.091957 -1.936256
H 3.962580 -1.491784 -0.682937
H 0.856203 -2.139903 1.332706
H 2.542475 -2.649037 1.036884
H 1.246454 -3.142544 -0.100647
H -4.427808 0.830473 -1.896431
H -5.014441 1.661714 -0.426791
H -3.668425 2.364403 -1.379973
H -4.034197 -1.366389 -0.434240
H -4.408740 -1.920130 1.943448
H -3.632754 -0.303128 2.464208
H 3.766160 1.576836 2.216367
H 2.059750 2.030198 2.418555
H 3.151892 3.088543 1.449796


