%chk=000093761.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093761

0 1
 O   0.2903000      -1.489400      0.2759000    
 O    1.496700     -0.2952000      -1.285900    
 C   -3.620300      0.1489000      0.4039000    
 C   -4.987200      0.6709000     -3.4699999E-02
 C   -3.454900      -1.327700      1.8300001E-02
 C   -2.495600       1.002300     -0.1987000    
 C   -2.074900      -1.856500      0.3979000    
 C   -1.118300      0.4670000      0.1812000    
 C  -0.9596000      -1.003200     -0.2007000    
 C   -5.146800       2.137800      0.3992000    
 C   -5.111900      0.5796000      -1.564900    
 C   -6.098000     -0.1719000      0.6143000    
 C    1.401300     -0.8399000     -0.1944000    
 C    2.490400     -0.9053000      0.8498000    
 C    3.746200     -0.1824000      0.4358000    
 C    4.734400     -0.8712000     -0.2523000    
 C    3.895000       1.160600      0.7495000    
 C    5.897000     -0.2022000     -0.6351000    
 C    5.057600       1.829700      0.3667000    
 C    6.058600       1.148100     -0.3257000    
 H   -3.542800      0.2190000       1.498600    
 H   -3.570100      -1.488500      -1.057400    
 H   -4.192500      -1.958300      0.5241000    
 H   -2.548200       2.037400      0.1529000    
 H   -2.535500       1.025500      -1.291500    
 H   -1.973700      -1.884200       1.490900    
 H   -1.964400      -2.896000      6.5499999E-02
 H  -0.3576000       1.092400     -0.2985000    
 H  -0.9584000      0.5864000       1.261200    
 H  -0.9879000      -1.112500      -1.293100    
 H   -4.918500       2.266800       1.463100    
 H   -6.178100       2.477500      0.2446000    
 H   -4.513300       2.820300     -0.1762000    
 H   -5.063500     -0.4412000      -1.951500    
 H   -4.389100       1.196600      -2.104100    
 H   -6.097800      0.9573000      -1.868500    
 H   -6.161000      -1.181800      0.1967000    
 H   -7.080000      0.2874000      0.4482000    
 H   -5.956500     -0.2530000       1.697900    
 H    2.719700      -1.959000       1.048600    
 H    2.107100     -0.4707000       1.781100    
 H    4.617400      -1.922400     -0.4999000    
 H    3.120300       1.700800       1.286300    
 H    6.676200     -0.7326000      -1.174800    
 H    5.183200       2.881400      0.6069000    
 H    6.963600       1.669100     -0.6241000    


%chk=000093761-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000093761

0 1
O 0.536380 -1.425427 0.457561
O 1.384246 -1.610922 -1.712662
C -3.419192 0.363529 0.248738
C -4.891449 0.812466 -0.100894
C -3.277659 -1.157476 0.542172
C -2.365272 0.772797 -0.818581
C -1.839671 -1.534380 0.980211
C -0.924803 0.403716 -0.383732
C -0.829802 -1.100487 -0.086185
C -4.938861 2.356392 -0.285270
C -5.420423 0.137967 -1.396438
C -5.842538 0.453302 1.076397
C 1.554510 -1.629587 -0.470485
C 2.892080 -1.848459 0.232793
C 3.705944 -0.553679 0.275820
C 4.256891 -0.013698 -0.914857
C 3.909249 0.130376 1.499627
C 5.003441 1.184624 -0.878683
C 4.657655 1.329575 1.537153
C 5.208207 1.859630 0.347941
H -3.154183 0.901068 1.189024
H -3.543156 -1.736285 -0.365879
H -3.980061 -1.468588 1.336197
H -2.405647 1.859655 -1.011502
H -2.592143 0.267943 -1.779628
H -1.591670 -1.028823 1.934267
H -1.760241 -2.623700 1.154448
H -0.202442 0.677538 -1.173840
H -0.652219 0.964513 0.532192
H -0.960447 -1.677719 -1.022647
H -4.503249 2.876144 0.589932
H -5.986383 2.695870 -0.392478
H -4.392371 2.686416 -1.186700
H -5.452203 -0.963082 -1.303372
H -4.796541 0.389746 -2.273348
H -6.449717 0.482794 -1.610506
H -5.958104 -0.638000 1.201701
H -6.850116 0.872807 0.895057
H -5.469382 0.870988 2.031610
H 3.437465 -2.620090 -0.338904
H 2.707080 -2.221787 1.252468
H 4.088704 -0.529628 -1.867454
H 3.480437 -0.275978 2.423485
H 5.425401 1.591141 -1.804829
H 4.810744 1.846717 2.491212
H 5.790111 2.787784 0.375970


