%chk=000013948.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013948

0 1
 O   -5.087300       1.341000      0.6322000    
 O    5.510100     -1.9700000E-02  0.1429000    
 C   -3.007600      1.8400000E-02  0.5675000    
 C   -2.396000     -0.8582000     -0.5496000    
 C  -0.8559000     -0.9612000     -0.5905000    
 C  -0.1462000      0.3934000     -0.3504000    
 C   -4.434900      0.2449000      1.6899999E-02
 C   -2.232400       1.342500      0.7430000    
 C   -2.959800     -0.2476000      -1.852800    
 C  -0.7233000       1.140700      0.8655000    
 C   -4.255000      0.4691000      -1.479900    
 C  -0.3187000      -2.021900      0.3830000    
 C   -3.111600     -0.7058000       1.919900    
 C    1.362600      0.2480000     -0.2189000    
 C    1.168200      -2.265300      0.1386000    
 C    1.970000     -0.9937000      4.3800000E-02
 C    2.174600       1.388100     -0.3547000    
 C    3.367800      -1.070300      0.1568000    
 C    3.560700       1.300300     -0.2303000    
 C    4.157400      7.0900001E-02  2.6300000E-02
 C    6.257500       1.186300     -9.3999999E-03
 H   -2.812700      -1.873300     -0.4761000    
 H  -0.5835000      -1.307600      -1.599400    
 H  -0.3248000       1.012800      -1.240500    
 H   -5.057000     -0.6473000      0.1661000    
 H   -2.594300       1.878900       1.629200    
 H   -2.415400       2.012000     -0.1068000    
 H   -3.141900      -1.031900      -2.596000    
 H   -2.268200      0.4678000      -2.310300    
 H  -0.2550000       2.129000      0.9579000    
 H  -0.4840000      0.6129000       1.796000    
 H   -4.193000       1.536100      -1.724100    
 H   -5.108400      7.0900001E-02  -2.039600    
 H  -0.8587000      -2.968100      0.2605000    
 H  -0.4551000      -1.710400       1.421900    
 H   -3.708100     -0.1268000       2.633700    
 H   -3.591200      -1.684900       1.810100    
 H   -2.138300     -0.8680000       2.386200    
 H    1.295900      -2.819900     -0.7996000    
 H    1.558500      -2.893300      0.9486000    
 H   -5.200700       1.129900       1.573800    
 H    1.725400       2.357100     -0.5610000    
 H    3.843800      -2.030600      0.3444000    
 H    4.111100       2.227500     -0.3472000    
 H    7.314700      0.9292000      0.1134000    
 H    6.012200       1.913000      0.7726000    
 H    6.145000       1.605000      -1.015200    


%chk=000013948-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000013948

0 1
O -5.210346 1.381818 0.589188
O 5.580537 -0.033392 0.138799
C -3.051175 -0.002157 0.593076
C -2.413979 -0.871157 -0.548474
C -0.862790 -0.984626 -0.562613
C -0.168375 0.390502 -0.342914
C -4.480725 0.248454 0.002613
C -2.275496 1.336386 0.758476
C -2.987218 -0.267098 -1.879953
C -0.753756 1.120906 0.902015
C -4.276594 0.520924 -1.499484
C -0.290191 -2.035173 0.422381
C -3.164337 -0.735580 1.950468
C 1.354332 0.262125 -0.248780
C 1.205752 -2.277623 0.133389
C 2.002501 -0.980554 0.018690
C 2.157344 1.417497 -0.401744
C 3.408956 -1.021852 0.140943
C 3.563840 1.383732 -0.288582
C 4.191642 0.145270 -0.007826
C 6.426987 1.152158 -0.000044
H -2.818513 -1.901430 -0.443143
H -0.584168 -1.337682 -1.581261
H -0.400067 1.037173 -1.216604
H -5.071201 -0.686435 0.146153
H -2.672473 1.885969 1.633440
H -2.463537 1.985999 -0.118888
H -3.194520 -1.073081 -2.606898
H -2.246016 0.402100 -2.354868
H -0.247974 2.098408 1.020511
H -0.520465 0.544340 1.818638
H -4.147955 1.608975 -1.641001
H -5.158023 0.219731 -2.090730
H -0.848009 -2.986879 0.321703
H -0.414825 -1.699788 1.469059
H -3.807827 -0.164830 2.651914
H -3.609265 -1.741504 1.825927
H -2.187355 -0.860715 2.447384
H 1.298957 -2.835737 -0.822310
H 1.653433 -2.924279 0.912339
H -5.408933 1.180254 1.538841
H 1.669867 2.376275 -0.621735
H 3.922798 -1.966880 0.350608
H 4.142797 2.302972 -0.418265
H 7.454682 0.792600 0.157947
H 6.178845 1.917655 0.761413
H 6.339334 1.596130 -1.011298


