%chk=000100992.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100992

0 1
 O   -2.245800      -1.930700     -0.3028000    
 O   -4.259600      -2.224600      0.7822000    
 C   -2.597700       2.363200      0.7127000    
 C   -3.642800       1.301000      0.2614000    
 C   -3.407200      0.6131000      -1.108500    
 C   -4.105200     -0.7623000      -1.156400    
 C   -1.187100       1.750500      0.7773000    
 C   -2.569600       3.589700     -0.2090000    
 C   -2.980600       2.832900       2.131900    
 C   -3.957900       1.467300      -2.258800    
 C    4.361000     -0.6185000     -0.2999000    
 C    2.886000     -0.4547000      7.7200003E-02
 C    5.110200      0.7141000     -0.1920000    
 C    2.091600      -1.762600      1.2900000E-02
 C    6.616500      0.5973000     -0.4904000    
 C   0.6117000      -1.594800      0.3659000    
 C   -3.587800      -1.728300     -0.1116000    
 C  -0.1249000      -2.937400      0.3131000    
 C   -1.609400      -2.792600      0.6300000    
 C    7.267800     -0.3710000      0.5004000    
 C    7.330800       1.948500     -0.4356000    
 H   -4.644800       1.751700      0.2699000    
 H   -3.666900      0.5348000       1.046500    
 H   -2.338700      0.4549000      -1.280500    
 H   -5.184500     -0.6450000     -0.9979000    
 H   -3.978000      -1.236600      -2.136900    
 H  -0.4779000       2.447700       1.238700    
 H   -1.183900      0.8330000       1.375700    
 H  -0.7939000       1.511700     -0.2153000    
 H   -2.061500       3.377500      -1.153700    
 H   -3.580400       3.953300     -0.4224000    
 H   -2.016000       4.415000      0.2548000    
 H   -3.976900       3.289300       2.139600    
 H   -2.990300       1.995400       2.838600    
 H   -2.271400       3.577000       2.512300    
 H   -5.010400       1.723700      -2.096100    
 H   -3.401500       2.392300      -2.403600    
 H   -3.894900      0.9186000      -3.205600    
 H    4.795600      -1.365200      0.3718000    
 H    4.443900      -1.008300      -1.321200    
 H    2.421900      0.2791000     -0.5936000    
 H    2.813800     -4.4900000E-02   1.092400    
 H    4.663300       1.431000     -0.8923000    
 H    4.969800       1.131700      0.8135000    
 H    2.176200      -2.182800     -0.9970000    
 H    2.546600      -2.489600      0.6971000    
 H    6.744300      0.1925000      -1.502300    
 H   0.1552000     -0.8882000     -0.3364000    
 H   0.5192000      -1.164200       1.369900    
 H   0.3301000      -3.641600       1.018900    
 H  -1.6100001E-02  -3.358600     -0.6938000    
 H   -2.080900      -3.781500      0.5878000    
 H   -1.732000      -2.388700       1.642200    
 H    7.041500     -9.8300003E-02   1.536800    
 H    8.357600     -0.3649000      0.3847000    
 H    6.944900      -1.402600      0.3335000    
 H    7.258200       2.394700      0.5621000    
 H    8.391700       1.841400     -0.6849000    
 H    6.887200       2.647800      -1.152000    


%chk=000100992-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000100992

0 1
O -2.077888 -1.869478 -0.307969
O -4.109929 -1.885362 0.830560
C -3.215588 2.377521 0.943555
C -4.135590 1.482437 0.048623
C -3.466579 0.803088 -1.187178
C -3.903527 -0.693991 -1.330994
C -2.135416 1.509410 1.645750
C -2.526184 3.495369 0.116682
C -4.109024 3.035367 2.030866
C -3.790220 1.547821 -2.505017
C 4.635108 -0.716955 -0.273298
C 3.153238 -0.479836 0.097676
C 5.478877 0.578298 -0.258850
C 2.314401 -1.777627 0.105377
C 6.938513 0.411144 -0.760499
C 0.826630 -1.543547 0.448638
C -3.430292 -1.539328 -0.165873
C 0.007383 -2.853377 0.473513
C -1.469834 -2.653272 0.811718
C 7.762182 -0.539493 0.142020
C 7.634506 1.789206 -0.869933
H -4.983895 2.103605 -0.307523
H -4.576025 0.706842 0.706463
H -2.366569 0.800495 -1.054631
H -5.005277 -0.755353 -1.375708
H -3.482651 -1.102212 -2.267676
H -1.515481 2.131220 2.319347
H -2.607465 0.712974 2.252241
H -1.455780 1.025720 0.919153
H -1.852779 3.078479 -0.654898
H -3.273277 4.135522 -0.390406
H -1.917758 4.143148 0.776353
H -4.881720 3.681365 1.571964
H -4.625230 2.267638 2.638081
H -3.504436 3.660945 2.714743
H -4.875316 1.506123 -2.720700
H -3.502588 2.611690 -2.438388
H -3.254734 1.102290 -3.364716
H 5.066043 -1.457821 0.430016
H 4.688913 -1.176466 -1.283042
H 2.706481 0.241717 -0.618062
H 3.097078 -0.000062 1.097291
H 4.972932 1.337864 -0.891712
H 5.498933 0.995064 0.770985
H 2.387383 -2.266078 -0.888997
H 2.753155 -2.491508 0.834434
H 6.894872 -0.034359 -1.778246
H 0.378703 -0.851149 -0.290869
H 0.750039 -1.043882 1.437442
H 0.434770 -3.543566 1.230019
H 0.087218 -3.365188 -0.505542
H -2.017108 -3.609800 0.897956
H -1.612655 -2.085772 1.750631
H 7.796887 -0.154915 1.180351
H 8.803714 -0.624323 -0.220752
H 7.333220 -1.557297 0.170808
H 7.702492 2.271953 0.124474
H 8.662356 1.690412 -1.266633
H 7.074886 2.470490 -1.538316


