%chk=000001929.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001929

0 1
 O    5.414600       1.366700      0.2754000    
 O   -6.284400      0.9263000       1.326200    
 O   -5.644200       1.063100     -0.8474000    
 C    3.987000       1.494500      0.2832000    
 C    4.663600      0.2721000     -0.2655000    
 C    3.452300       2.554900     -0.6302000    
 C    4.739000     -0.9771000      0.5262000    
 C    2.056600       2.238000      -1.172900    
 C   0.9939000       2.150200     -7.3500000E-02
 C  -0.4061000       1.826300     -0.6068000    
 C    3.629300      -1.965600      0.2618000    
 C   -1.523200       1.778100      0.4408000    
 C    2.440400      -1.944600      0.8819000    
 C   -2.907900       1.510500     -0.1586000    
 C    1.345400      -2.938000      0.6213000    
 C   8.5299999E-02  -2.296100      3.2400001E-02
 C   -3.990400       1.377200      0.9141000    
 C   -1.042300      -3.303600     -0.2130000    
 C   -2.267200      -2.624800     -0.8265000    
 C   -5.366900       1.118600      0.3425000    
 C   -3.374800      -3.626900      -1.111200    
 H    3.494700       1.453800       1.244800    
 H    4.705400      0.1159000      -1.335200    
 H    3.429600       3.508300     -8.9299999E-02
 H    4.130700       2.695300      -1.481200    
 H    5.692400      -1.476200      0.3129000    
 H    4.764300     -0.7510000       1.600800    
 H    1.771000       3.017200      -1.889600    
 H    2.085700       1.289700      -1.723400    
 H    1.265600       1.376400      0.6532000    
 H   0.9590000       3.101200      0.4716000    
 H  -0.6717000       2.576000      -1.363100    
 H  -0.3703000      0.8614000      -1.128300    
 H    3.830400      -2.729800     -0.4849000    
 H   -1.545500       2.728700      0.9877000    
 H   -1.286500      0.9965000       1.173100    
 H    2.241300      -1.177500       1.626100    
 H   -3.169900       2.323800     -0.8467000    
 H   -2.876400      0.5939000     -0.7600000    
 H    1.095000      -3.427200       1.570500    
 H    1.696000      -3.728800     -5.3399999E-02
 H   0.3412000      -1.801700     -0.9137000    
 H  -0.2745000      -1.510800      0.7097000    
 H   -3.740400      0.5435000       1.580100    
 H   -4.039400       2.299100       1.504300    
 H  -0.6846000      -4.094100     -0.8838000    
 H   -1.319300      -3.782800      0.7337000    
 H   -2.645200      -1.856300     -0.1426000    
 H   -1.988800      -2.121700      -1.759800    
 H   -3.039500      -4.391700      -1.818900    
 H   -3.697500      -4.126200     -0.1921000    
 H   -4.242300      -3.119400      -1.544800    
 H   -7.177800      0.7476000      0.9627000    


%chk=000001929-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001929

0 1
O 5.586643 1.477427 0.541203
O -6.295795 0.646727 0.769294
O -5.583831 1.098131 -1.393316
C 4.075419 1.596836 0.394801
C 4.782688 0.402461 -0.163879
C 3.566209 2.719229 -0.492377
C 4.733086 -0.961008 0.516942
C 2.191177 2.399725 -1.135215
C 1.046923 2.172383 -0.119039
C -0.323793 1.975133 -0.803899
C 3.598946 -1.814077 -0.021887
C -1.472221 1.691350 0.190144
C 2.556950 -2.277409 0.717372
C -2.836523 1.509446 -0.509825
C 1.407729 -3.109118 0.189130
C 0.030789 -2.411751 0.363802
C -3.961149 1.166351 0.484480
C -1.154779 -3.297978 -0.079694
C -2.526187 -2.600865 0.071500
C -5.311656 0.982889 -0.178572
C -3.711004 -3.493842 -0.355520
H 3.559109 1.455428 1.355575
H 4.958553 0.387766 -1.250839
H 3.494630 3.652776 0.100542
H 4.318240 2.899463 -1.284311
H 5.706265 -1.468431 0.355783
H 4.622052 -0.813175 1.607120
H 1.913636 3.237176 -1.806922
H 2.288498 1.500292 -1.777133
H 1.269949 1.281206 0.502048
H 0.992233 3.037686 0.574581
H -0.569150 2.877317 -1.402249
H -0.251911 1.134544 -1.526005
H 3.638067 -2.059232 -1.095668
H -1.537042 2.522300 0.923662
H -1.229512 0.778007 0.773312
H 2.520689 -2.032991 1.792189
H -3.101968 2.429223 -1.065311
H -2.763225 0.706870 -1.269285
H 1.373411 -4.081378 0.725462
H 1.571308 -3.342892 -0.881383
H 0.029355 -1.465537 -0.215661
H -0.102168 -2.127595 1.428801
H -3.728919 0.236792 1.040670
H -4.068323 1.954544 1.255977
H -1.013742 -3.600712 -1.138297
H -1.153995 -4.236009 0.514335
H -2.659468 -2.288926 1.128510
H -2.527770 -1.670826 -0.533714
H -3.615057 -3.799156 -1.414428
H -3.754493 -4.414286 0.256778
H -4.676477 -2.966749 -0.243221
H -7.169700 0.537365 0.304238


