%chk=000170769.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170769

0 1
 O    1.960900      0.7244000      0.3922000    
 O    2.791000      -1.260900       1.209600    
 C   -2.171300      0.1766000     -0.3938000    
 C   -3.643800     -0.1885000     -0.2155000    
 C   -1.752600       1.250300      0.6204000    
 C   -1.285000      -1.070500     -0.2695000    
 C  -0.2707000       1.592000      0.4973000    
 C   0.1956000     -0.7224000     -0.3897000    
 C   0.6068000      0.3488000      0.6183000    
 C   -4.051100      -1.233200      -1.268300    
 C   -3.868100     -0.7724000       1.189600    
 C   -4.515000       1.067300     -0.3862000    
 C    2.883700     -0.2759000      0.4908000    
 C    4.034800      6.2000002E-03 -0.4114000    
 C    4.050100       1.245500      -1.252900    
 C    5.034800     -0.8872000     -0.4309000    
 H   -2.023300      0.5926000      -1.400900    
 H   -1.918400      0.9294000       1.652700    
 H   -2.311500       2.179500      0.4727000    
 H   -1.510100      -1.799700      -1.053900    
 H   -1.414300      -1.574300      0.6926000    
 H  -8.0300003E-02   2.087000     -0.4641000    
 H   1.3500000E-02   2.321600       1.265500    
 H   0.7800000      -1.640100     -0.2630000    
 H   0.4135000     -0.3731000      -1.407900    
 H   0.5147000     -4.2399999E-02   1.640400    
 H   -3.609700      -2.217000      -1.080500    
 H   -5.137600      -1.382300      -1.265800    
 H   -3.769500     -0.9137000      -2.277800    
 H   -3.652500     -7.0400000E-02   1.998700    
 H   -3.323800      -1.701800       1.373200    
 H   -4.929400      -1.031100       1.306200    
 H   -4.275900       1.596100      -1.315600    
 H   -5.577500      0.7988000     -0.4291000    
 H   -4.413000       1.769100      0.4476000    
 H    3.193200       1.257400      -1.934500    
 H    4.009400       2.139300     -0.6217000    
 H    4.957000       1.314500      -1.863300    
 H    5.901400     -0.7383000      -1.067600    
 H    5.028800      -1.786400      0.1761000    


%chk=000170769-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170769

0 1
O 2.017917 0.499313 -0.210435
O 2.887777 -1.302978 0.995849
C -2.302923 0.083324 -0.359042
C -3.837851 -0.168278 -0.093640
C -1.664457 1.135946 0.591155
C -1.438300 -1.208709 -0.333169
C -0.186901 1.429604 0.226651
C 0.039516 -0.923439 -0.702931
C 0.632187 0.135322 0.240783
C -4.400032 -1.151355 -1.159848
C -4.102458 -0.758309 1.318506
C -4.620238 1.169423 -0.230359
C 3.063185 -0.314494 0.237858
C 4.383504 0.162275 -0.300354
C 4.407316 1.367304 -1.217661
C 5.494987 -0.529704 0.073518
H -2.236899 0.497758 -1.392087
H -1.713592 0.768463 1.636479
H -2.229766 2.084619 0.558159
H -1.836944 -1.961308 -1.037013
H -1.477704 -1.662596 0.677904
H -0.130462 1.877558 -0.785144
H 0.249110 2.159400 0.934200
H 0.636164 -1.851846 -0.647240
H 0.098231 -0.543306 -1.742402
H 0.713076 -0.279821 1.264359
H -3.974685 -2.165534 -1.056803
H -5.497635 -1.242245 -1.054917
H -4.186765 -0.791829 -2.185067
H -3.750864 -0.082143 2.119063
H -3.607923 -1.737451 1.454555
H -5.188085 -0.911770 1.467626
H -4.404314 1.661791 -1.198381
H -5.709641 0.982188 -0.182603
H -4.373351 1.880803 0.577972
H 3.791933 1.191139 -2.118115
H 3.979278 2.254178 -0.717074
H 5.439093 1.599102 -1.532333
H 6.491920 -0.242283 -0.277751
H 5.411395 -1.395312 0.739728


