%chk=000161442.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161442

0 1
 O    1.469800      -1.320200      0.3692000    
 O    3.758800      -1.601900      0.2362000    
 C   -1.597400       1.037300      0.1903000    
 C  -0.8479000     -0.3203000      0.1335000    
 C   0.6316000     -0.1626000      0.4501000    
 C  -0.8235000       2.152500     -0.5875000    
 C    1.267000      0.8154000     -0.5193000    
 C   -3.009100      0.9413000     -0.4482000    
 C   0.6866000       2.205300     -0.3132000    
 C   -1.481200      -1.480200     -0.1651000    
 C   -3.751200     -0.3091000     -8.2999999E-03
 C   -1.752600       1.469100       1.668800    
 C   -2.973100      -1.554800     -0.4108000    
 C    2.692100      0.5247000     -0.2258000    
 C    2.761900     -0.9083000      0.1557000    
 C  -0.7910000      -2.812700     -0.2909000    
 C    3.759200       1.324400     -0.2346000    
 H   0.7108000      0.1829000       1.491000    
 H   -1.261500       3.135300     -0.3714000    
 H  -0.9519000       1.993800      -1.667400    
 H    1.082700      0.4984000      -1.557300    
 H   -2.929300      0.9237000      -1.543800    
 H   -3.604100       1.829100     -0.1998000    
 H    1.156200       2.921900     -0.9969000    
 H   0.8776000       2.566600      0.7042000    
 H   -4.746200     -0.3349000     -0.4677000    
 H   -3.910600     -0.2999000       1.076000    
 H   -2.376900       2.366400       1.752400    
 H   -2.218200      0.6841000       2.274700    
 H  -0.7924000       1.708300       2.136600    
 H   -3.133100      -1.749700      -1.479100    
 H   -3.396300      -2.406900      0.1355000    
 H   -1.484900      -3.592000     -0.6256000    
 H  -0.3888000      -3.135200      0.6745000    
 H   7.4999998E-03  -2.773200      -1.038300    
 H    3.669100       2.371000     -0.5047000    
 H    4.746700      0.9582000      2.4800001E-02


%chk=000161442-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000161442

0 1
O 1.525559 -1.345690 0.390194
O 3.840143 -1.611281 0.230578
C -1.596502 1.033266 0.220834
C -0.864106 -0.345527 0.113561
C 0.605902 -0.155107 0.437743
C -0.829348 2.156266 -0.569417
C 1.292681 0.868185 -0.510867
C -3.022039 0.944255 -0.397439
C 0.690362 2.259254 -0.284550
C -1.509356 -1.515859 -0.185419
C -3.779156 -0.319169 0.043844
C -1.721541 1.458660 1.719883
C -3.016241 -1.561723 -0.448223
C 2.757306 0.580608 -0.262279
C 2.846658 -0.870882 0.135221
C -0.865032 -2.888048 -0.303939
C 3.846583 1.380121 -0.357722
H 0.697050 0.224262 1.477422
H -1.322765 3.124977 -0.355842
H -0.960086 1.963843 -1.654092
H 1.057474 0.548906 -1.550479
H -2.935568 0.932496 -1.503468
H -3.585967 1.859212 -0.128047
H 1.146416 3.008317 -0.959607
H 0.888254 2.595291 0.751995
H -4.808269 -0.314503 -0.362873
H -3.871557 -0.345664 1.146557
H -2.290039 2.405099 1.797258
H -2.251078 0.689027 2.308044
H -0.741063 1.624346 2.199869
H -3.178160 -1.693201 -1.540490
H -3.424617 -2.477994 0.023508
H -1.109112 -3.331687 -1.290526
H -1.293545 -3.571428 0.456739
H 0.224158 -2.873932 -0.181363
H 3.769511 2.433966 -0.647370
H 4.843489 0.979137 -0.141441


