%chk=000161949.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161949

0 1
 O   -3.182600     -0.4013000     -0.5623000    
 C   -2.108300     -2.1700000E-02  0.3106000    
 C   -1.223200      0.9855000     -0.4546000    
 C   -1.401900      -1.314600      0.8033000    
 C  -1.3500000E-02   1.503400      0.3305000    
 C  -0.7280000      -2.221100     -0.2446000    
 C    1.029100       2.150800     -0.5868000    
 C   0.6941000      -1.847600     -0.6845000    
 C    2.418100       2.294900      5.4800000E-02
 C    1.743600      -1.933600      0.4300000    
 C   -2.773800      0.6651000       1.512800    
 C    3.058500      0.9933000      0.5641000    
 C    3.153900      -1.511900     -1.6899999E-02
 C    3.286600     -6.7299999E-02 -0.5213000    
 C   -3.952400      0.7261000     -0.9351000    
 H   -1.775700       1.888000     -0.7370000    
 H  -0.9188000      0.5372000      -1.407400    
 H   -2.183200      -1.937200       1.264500    
 H  -0.7012000      -1.086800       1.612100    
 H   0.4338000      0.6763000      0.8766000    
 H  -0.3359000       2.230300       1.085600    
 H   -1.366900      -2.280000      -1.133800    
 H  -0.6895000      -3.238400      0.1669000    
 H   0.6719000       3.146200     -0.8791000    
 H    1.119900       1.584100      -1.519200    
 H   0.6885000     -0.8566000      -1.134400    
 H   0.9906000      -2.536800      -1.485800    
 H    2.344500       2.994400      0.8969000    
 H    3.091700       2.759100     -0.6760000    
 H    1.794100      -2.971600      0.7823000    
 H    1.444800      -1.338600       1.295900    
 H   -3.043300       1.710100       1.323700    
 H   -3.674900      0.1327000       1.839700    
 H   -2.084700      0.6979000       2.365500    
 H    2.471300      0.5997000       1.397700    
 H    4.033000       1.244300       1.003500    
 H    3.482500      -2.187700     -0.8164000    
 H    3.846900      -1.662700      0.8200000    
 H    2.631400      7.6800004E-02  -1.382700    
 H    4.303900      6.4999998E-02 -0.9125000    
 H   -3.444400       1.379000      -1.648500    
 H   -4.406600       1.285000     -0.1155000    
 H   -4.805400      0.3264000      -1.497600    


%chk=000161949-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000161949

0 1
O -3.180388 -0.465724 -0.535852
C -2.127182 0.072522 0.386263
C -1.211934 1.063430 -0.387860
C -1.417400 -1.229555 0.868763
C 0.043187 1.534823 0.387875
C -0.790524 -2.151808 -0.214111
C 1.104133 2.207874 -0.517439
C 0.647236 -1.819749 -0.700154
C 2.515905 2.314824 0.123695
C 1.749673 -1.963033 0.377317
C -2.794237 0.761471 1.601477
C 3.134637 0.961086 0.575166
C 3.171865 -1.562929 -0.105722
C 3.321837 -0.084346 -0.561063
C -4.087538 0.500198 -1.150180
H -1.806787 1.952173 -0.681563
H -0.899765 0.572686 -1.330247
H -2.202859 -1.809665 1.391640
H -0.668456 -0.965839 1.639980
H 0.503451 0.660082 0.877675
H -0.245651 2.229965 1.201750
H -1.480112 -2.168334 -1.079216
H -0.776960 -3.185037 0.191412
H 0.762031 3.222126 -0.807814
H 1.176821 1.634786 -1.464253
H 0.672054 -0.798990 -1.120553
H 0.892641 -2.500277 -1.542684
H 2.466082 2.989367 1.003616
H 3.196421 2.802523 -0.604508
H 1.775656 -3.016924 0.724224
H 1.482773 -1.362435 1.270353
H -3.286995 1.710189 1.319354
H -3.550341 0.091668 2.048802
H -2.041050 0.995431 2.375360
H 2.502064 0.529442 1.374370
H 4.114499 1.162644 1.052477
H 3.458055 -2.224099 -0.950221
H 3.896882 -1.766530 0.709555
H 2.595555 0.108965 -1.372228
H 4.322336 0.049010 -1.019020
H -3.564719 1.204331 -1.829308
H -4.659620 1.083470 -0.399512
H -4.794773 -0.103710 -1.742616


