%chk=000094685.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094685

0 1
 O   -4.375600     -0.5885000      -1.729000    
 C    2.864300      -1.902200      0.1151000    
 C    3.503700      -1.134800      -1.045100    
 C    1.605300      -2.673700     -0.2936000    
 C    4.759100     -0.3519000     -0.6376000    
 C   0.9529000      -3.425200      0.8680000    
 C    4.550800      0.6992000      0.4587000    
 C  -0.2471000      -4.234400      0.4004000    
 C    3.594600       1.783100      5.3300001E-02
 C    2.492500       2.100100      0.7493000    
 C    1.521800       3.164000      0.3361000    
 C   0.1977000       2.566800      0.1247000    
 C  -0.8794000       2.065200     -4.8099998E-02
 C   -4.466400      0.2947000     -0.6146000    
 C   -2.101900       1.473900     -0.2417000    
 C   -3.166900      0.9450000     -0.4083000    
 C   -4.842200     -0.4927000      0.6053000    
 C   -5.963200     -0.2889000       1.307200    
 H    2.588300      -1.209000      0.9169000    
 H    3.597900      -2.601000      0.5351000    
 H    3.778700      -1.844300      -1.835400    
 H    2.766800     -0.4520000      -1.484600    
 H   0.8778000      -1.974500     -0.7246000    
 H    1.867400      -3.386300      -1.085500    
 H    5.170200      0.1335000      -1.532100    
 H    5.522300      -1.062100     -0.2953000    
 H   0.6346000      -2.713300       1.638100    
 H    1.682900      -4.099800       1.330100    
 H    5.519100       1.171100      0.6680000    
 H    4.241900      0.2207000       1.394500    
 H  -0.7004000      -4.762300       1.245300    
 H   4.7699999E-02  -4.978500     -0.3464000    
 H   -1.008900      -3.585000     -4.2800002E-02
 H    3.824700       2.325400     -0.8604000    
 H    2.274500       1.562200       1.669600    
 H    1.851300       3.672300     -0.5772000    
 H    1.469200       3.922400       1.125100    
 H   -5.226300       1.045900     -0.8550000    
 H   -4.170400      -1.285300      0.9281000    
 H   -3.737300      -1.291000      -1.515000    
 H   -6.184200     -0.8968000       2.177800    
 H   -6.674700      0.4809000       1.029700    


%chk=000094685-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000094685

0 1
O -3.718859 -1.635794 -1.440266
C 2.759550 -1.817538 0.030557
C 3.427133 -1.038371 -1.126398
C 1.296792 -2.203942 -0.288126
C 4.812797 -0.431799 -0.794575
C 0.615970 -3.025989 0.829803
C 4.791187 0.644103 0.335789
C -0.895029 -3.233580 0.583336
C 3.791687 1.747529 0.061230
C 2.722337 2.031947 0.847136
C 1.655811 3.074088 0.516531
C 0.355653 2.421217 0.274310
C -0.690489 1.783059 0.069619
C -4.052045 -0.440157 -0.613427
C -1.835147 1.063603 -0.162176
C -2.860334 0.394519 -0.376747
C -4.714557 -0.849975 0.694167
C -6.021336 -0.631972 0.977653
H 2.763688 -1.201210 0.951921
H 3.351740 -2.728618 0.259285
H 3.531023 -1.712442 -2.001297
H 2.745441 -0.222712 -1.441857
H 0.715758 -1.273832 -0.461087
H 1.260022 -2.775335 -1.239470
H 5.228574 0.029000 -1.714081
H 5.517724 -1.235636 -0.499793
H 0.758944 -2.508928 1.800608
H 1.117768 -4.010474 0.923374
H 5.811626 1.070169 0.425373
H 4.559714 0.169794 1.308189
H -1.358940 -3.855199 1.370960
H -1.071014 -3.732714 -0.389790
H -1.410972 -2.252440 0.575504
H 3.935830 2.316697 -0.872049
H 2.551740 1.454574 1.767238
H 1.957201 3.653606 -0.378159
H 1.552358 3.801912 1.347562
H -4.779329 0.102461 -1.243325
H -4.062426 -1.362526 1.416280
H -2.954151 -2.108005 -1.015873
H -6.465719 -0.960077 1.923702
H -6.684620 -0.116113 0.272472


