%chk=000163935.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163935

0 1
 O  -2.3300000E-02  -1.442200       1.491700    
 O   -2.728200      -1.842700       1.343800    
 O    1.206600      0.5234000       2.705500    
 O   -1.494700       2.699100      0.3513000    
 O    2.294200      -2.561900     -0.3235000    
 O    4.169400      -1.200400      -1.662800    
 C  -0.2054000     -0.1607000      0.8628000    
 C   0.2978000      -1.386100      9.3599997E-02
 C   -1.671000      0.2816000      0.7041000    
 C   -2.586700     -0.8994000      0.2719000    
 C  -0.6450000      -2.251200     -0.7046000    
 C   0.8068000      0.8488000       1.370300    
 C   -2.004300      -1.610300     -0.9659000    
 C   -1.764200       1.461800     -0.3132000    
 C    1.758300      -1.474100     -0.1666000    
 C   -4.028900     -0.4165000      1.2200000E-02
 C    2.023400      0.9173000      0.4785000    
 C    2.505100     -0.2025000     -0.2172000    
 C   -3.087100       1.633700      -1.002300    
 C   -4.128700      0.8035000     -0.8529000    
 C    2.752800       2.113700      0.4011000    
 C    3.685400     -0.1347000     -0.9648000    
 C   -5.447000       1.046100      -1.524400    
 C    3.924200       2.188400     -0.3547000    
 C    4.390700       1.065100      -1.034000    
 H   -1.993700      0.6252000       1.697100    
 H  -0.7832000      -3.204500     -0.1784000    
 H  -0.1907000      -2.501000      -1.671300    
 H   0.3651000       1.844200       1.430400    
 H   -1.908100     -0.9090000      -1.803000    
 H   -2.685200      -2.402500      -1.302500    
 H  -0.9972000       1.347200      -1.088300    
 H   -4.529900     -0.2035000      0.9668000    
 H   -4.602000      -1.238200     -0.4385000    
 H   -3.186900       2.502700      -1.649000    
 H   -3.252500      -2.593700       1.016500    
 H   0.4031000      0.5136000       3.253400    
 H   -2.141400       2.801400       1.070600    
 H    2.416900       2.996700      0.9399000    
 H   -5.446500       1.968100      -2.115200    
 H   -6.243000       1.129500     -0.7774000    
 H   -5.688000      0.2180000      -2.199000    
 H    4.476800       3.122100     -0.4063000    
 H    5.304700       1.133200      -1.618000    
 H    3.557600      -1.950900      -1.604000    


%chk=000163935-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000163935

0 1
O 0.288554 -1.147876 1.246935
O -2.442745 -1.703176 1.538080
O 0.524584 1.647952 2.157837
O -1.585151 2.794950 -0.185627
O 2.030445 -2.033855 -1.704483
O 4.443857 -1.230612 -1.583580
C -0.212189 0.054213 0.481543
C 0.277202 -1.154838 -0.288469
C -1.720562 0.365519 0.493023
C -2.612884 -0.895180 0.306131
C -0.691223 -2.170877 -0.879512
C 0.721609 1.239671 0.747396
C -2.160842 -1.691689 -0.942402
C -2.016120 1.436422 -0.616737
C 1.675668 -1.125236 -0.853896
C -4.111760 -0.509249 0.227999
C 2.194002 0.979087 0.446267
C 2.611698 -0.105790 -0.390041
C -3.454485 1.511306 -1.074016
C -4.432334 0.644226 -0.704194
C 3.150928 1.881432 0.940657
C 4.004469 -0.227728 -0.751857
C -5.869173 0.782755 -1.157644
C 4.521895 1.728420 0.601254
C 4.953427 0.691707 -0.243340
H -1.971535 0.806378 1.479068
H -0.615162 -3.078222 -0.253695
H -0.338221 -2.452981 -1.886547
H 0.372864 2.123330 0.186465
H -2.319296 -1.058497 -1.836476
H -2.820203 -2.573929 -1.068211
H -1.357726 1.259273 -1.490446
H -4.446131 -0.258503 1.256072
H -4.696706 -1.405143 -0.072301
H -3.672053 2.353487 -1.743593
H -2.955784 -2.545318 1.427869
H 0.764618 0.862340 2.718254
H -2.096616 3.042596 0.627181
H 2.822443 2.702396 1.584183
H -6.021802 1.686312 -1.771975
H -6.553930 0.837834 -0.288181
H -6.185717 -0.096891 -1.752335
H 5.256428 2.441223 0.992271
H 6.002305 0.572021 -0.527539
H 3.619452 -1.780861 -1.867687


