%chk=000085778.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085778

0 1
 O    1.867200      -2.382700     -0.1078000    
 C    1.628900      -1.056100      0.3893000    
 C   0.6305000      -1.766100     -0.4965000    
 C    2.648300     -4.3600000E-02 -7.9599999E-02
 C  -0.5656000      -2.487900      5.6400001E-02
 C   -1.757400      -1.563800      0.3634000    
 C    2.163500       1.402100      0.1555000    
 C    4.074100     -0.2781000      0.4278000    
 C   -2.225700     -0.8449000     -0.8759000    
 C   -2.914400      -2.378500      0.9472000    
 C    1.239200       1.968600     -0.8875000    
 C  -0.9260000       1.970300      0.4501000    
 C  -6.4000003E-02   2.259200     -0.7528000    
 C   -2.353600       1.524600      6.3699998E-02
 C   -2.447400      0.4713000      -1.005500    
 C  -0.9976000       3.205500       1.352200    
 H    1.407600     -0.9623000       1.445800    
 H   0.5240000      -1.457300      -1.527200    
 H    2.727000     -0.1693000      -1.170300    
 H  -0.2850000      -3.018000      0.9764000    
 H  -0.8618000      -3.261600     -0.6640000    
 H   -1.441700     -0.8458000       1.127100    
 H    3.035700       2.070000      0.1677000    
 H    1.730100       1.487300       1.158700    
 H    4.413200      -1.290500      0.1848000    
 H    4.775700      0.4324000     -2.0800000E-02
 H    4.118100     -0.1668000       1.516400    
 H   -2.382900      -1.463400      -1.758400    
 H   -3.762300      -1.731400       1.198900    
 H   -3.268600      -3.139000      0.2419000    
 H   -2.603600      -2.889600       1.864900    
 H    1.708600       2.217700      -1.837800    
 H  -0.4738000       1.162000       1.034600    
 H  -0.5566000       2.734800      -1.599600    
 H   -2.926700       2.394400     -0.2866000    
 H   -2.881000       1.177100      0.9619000    
 H   -2.764000      0.8270000      -1.984600    
 H   -1.445700       4.059000      0.8309000    
 H   -1.601200       2.999400       2.242800    
 H   5.0000002E-04   3.505500       1.690300    


%chk=000085778-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000085778

0 1
O 1.955641 -2.499745 -0.410013
C 1.777702 -1.172934 0.307916
C 0.646910 -1.728432 -0.503829
C 2.705261 -0.060091 -0.164611
C -0.541248 -2.439468 0.120784
C -1.776739 -1.530716 0.396264
C 2.140527 1.352647 0.207794
C 4.115934 -0.287895 0.427390
C -2.236274 -0.836810 -0.874705
C -2.928863 -2.386623 0.991780
C 1.242121 1.956369 -0.856265
C -0.976943 2.002530 0.446520
C -0.083331 2.245437 -0.758598
C -2.421528 1.579417 0.018563
C -2.509961 0.485454 -1.039199
C -1.049893 3.263683 1.351800
H 1.715795 -1.294273 1.402734
H 0.483886 -1.282943 -1.495042
H 2.772626 -0.133941 -1.268635
H -0.213805 -2.915185 1.065619
H -0.850290 -3.262354 -0.556685
H -1.490339 -0.769700 1.147139
H 3.005776 2.031989 0.352446
H 1.626717 1.301280 1.186881
H 4.482301 -1.300182 0.180867
H 4.836182 0.449218 0.027390
H 4.105510 -0.185231 1.529979
H -2.368835 -1.505285 -1.742124
H -3.802283 -1.756855 1.237697
H -3.260403 -3.155192 0.267912
H -2.602446 -2.906575 1.912377
H 1.752630 2.193196 -1.803445
H -0.542504 1.178847 1.045517
H -0.574756 2.715492 -1.625388
H -2.939890 2.481100 -0.363648
H -2.966949 1.275229 0.934706
H -2.833411 0.811122 -2.038604
H -1.428509 4.132600 0.781068
H -1.729231 3.097708 2.210040
H -0.051491 3.528613 1.743408


