%chk=000162431.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162431

0 1
 O   -2.384700      -2.564900     -0.7807000    
 O   0.2414000      -3.008300     -4.5600001E-02
 O    3.348900       2.656900     -7.0699997E-02
 O    3.329400      -2.877600     -0.3547000    
 O    3.153700      -1.750600       1.618900    
 C   -1.366100      0.9523000      0.3616000    
 C   -2.237900     -0.1648000     -0.3190000    
 C   0.1371000      0.8001000     -0.1132000    
 C   0.7316000     -0.6302000      0.1495000    
 C   -3.803400     -3.1700000E-02 -6.4999998E-02
 C   -1.657800      -1.574900     -4.7200002E-02
 C   -1.877300       2.358400     -8.8000000E-02
 C  -0.1889000      -1.708100     -0.4594000    
 C   -4.212500       1.437200      0.2281000    
 C   -3.341700       2.433600     -0.5110000    
 C    1.071000       1.913500      0.4563000    
 C    2.200100     -0.8142000     -0.3999000    
 C   -1.436500      0.8651000       1.908600    
 C   -4.328700     -0.9076000       1.093000    
 C   -4.572500     -0.4700000      -1.342100    
 C    2.986200      0.4493000     -0.3789000    
 C    2.447400       1.651000      3.5000001E-03
 C    2.935100      -1.837400      0.4197000    
 C    4.326800      0.7355000     -0.7371000    
 C    4.499300       2.087400     -0.5265000    
 H   -2.112500     -6.0999999E-03  -1.402700    
 H   0.1342000      0.9242000      -1.208800    
 H   0.7665000     -0.7850000       1.236600    
 H   -1.768800      -1.835900       1.011200    
 H   -1.292900       2.724500     -0.9420000    
 H   -1.705300       3.087000      0.7152000    
 H  -0.1180000      -1.692000      -1.554000    
 H   -4.169500       1.654900       1.300900    
 H   -5.261400       1.604100     -4.9699999E-02
 H   -3.713700       3.451300     -0.3434000    
 H   -3.416800       2.259100      -1.591200    
 H    1.072500       1.910300       1.550100    
 H   0.7531000       2.905400      0.1213000    
 H    2.151000      -1.147400      -1.445300    
 H   -2.448600      0.9928000       2.292500    
 H   -1.068300     -9.0599999E-02   2.290200    
 H  -0.8484000       1.653800       2.387400    
 H   -5.388500     -0.7014000       1.286000    
 H   -4.253900      -1.976300      0.8693000    
 H   -3.789100     -0.7258000       2.025700    
 H   -5.654500     -0.3449000      -1.214200    
 H   -4.275500      0.1235000      -2.213400    
 H   -4.405500      -1.522200      -1.586400    
 H   -2.000400      -3.431200     -0.5624000    
 H   0.2074000      -3.039500      0.9258000    
 H    5.076000      4.7100000E-02  -1.101300    
 H    5.334700       2.761200     -0.6500000    
 H    3.812500      -3.556700      0.1626000    


%chk=000162431-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000162431

0 1
O -2.487256 -2.588398 -0.661412
O 0.190853 -3.062423 -0.247755
O 3.430954 2.623134 -0.014016
O 3.976063 -2.416680 -0.336265
O 2.474786 -2.506621 1.417921
C -1.388532 0.978875 0.359716
C -2.290858 -0.141708 -0.300642
C 0.107821 0.805892 -0.137641
C 0.693064 -0.617850 0.143360
C -3.852197 -0.020520 -0.016181
C -1.712384 -1.536984 0.019303
C -1.887660 2.387547 -0.141131
C -0.258709 -1.663828 -0.466465
C -4.243846 1.473948 0.233621
C -3.370520 2.432769 -0.594180
C 1.040378 1.923505 0.425326
C 2.135884 -0.846781 -0.420624
C -1.446980 0.927196 1.915561
C -4.335263 -0.880814 1.183443
C -4.610325 -0.507386 -1.287682
C 2.984236 0.409100 -0.350904
C 2.444137 1.620962 0.029091
C 2.829580 -1.987488 0.331230
C 4.384392 0.639361 -0.655579
C 4.619627 1.984092 -0.439419
H -2.172149 -0.006142 -1.399371
H 0.085357 0.934767 -1.243033
H 0.744262 -0.766079 1.241857
H -1.740589 -1.726375 1.115629
H -1.255970 2.720976 -0.988796
H -1.732236 3.124695 0.670887
H -0.263468 -1.570194 -1.570374
H -4.159987 1.732750 1.307634
H -5.312327 1.601225 -0.030268
H -3.745997 3.471213 -0.517332
H -3.448267 2.154940 -1.664103
H 0.961263 1.976748 1.528340
H 0.734516 2.911535 0.036717
H 2.071957 -1.180883 -1.477035
H -2.481965 1.021330 2.277304
H -1.035511 -0.010087 2.331048
H -0.879632 1.764154 2.360219
H -5.412010 -0.692307 1.358123
H -4.207383 -1.955711 0.970067
H -3.802355 -0.642337 2.121686
H -5.701591 -0.513774 -1.102083
H -4.418352 0.162041 -2.149082
H -4.288793 -1.525083 -1.560508
H -1.904529 -3.397144 -0.640288
H 0.556841 -3.142431 0.674286
H 5.106803 -0.103393 -0.985969
H 5.491273 2.626000 -0.525012
H 4.399897 -3.155134 0.180984


