%chk=000076380.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076380

0 1
 O   0.1738000      5.1300000E-02   2.279900    
 O    5.482800     -0.3913000     -0.9524000    
 O   -2.999600      -4.533900     -0.3001000    
 O   -2.564800       4.714500     -0.7525000    
 C   0.1408000      1.8600000E-02  0.8164000    
 C    1.552600     -9.0099998E-02  0.3487000    
 C  -0.7303000      -1.244800      0.5069000    
 C  -0.6101000       1.322800      0.3807000    
 C    1.858900     -0.8595000     -0.7738000    
 C  -0.7621000      -2.226200       1.446700    
 C   8.2500003E-02   2.218700     -0.3700000    
 C    2.567100      0.5785000       1.033900    
 C   -1.392900      -1.268700     -0.6798000    
 C   -1.899700       1.461800      0.7852000    
 C    3.179700     -0.9605000      -1.211000    
 C   -1.538700      -3.351500       1.170500    
 C  -0.5867000       3.379500     -0.7580000    
 C    3.887700      0.4777000      0.5966000    
 C   -2.169600      -2.393900     -0.9559000    
 C   -2.569000       2.622400      0.3972000    
 C    4.194100     -0.2919000     -0.5257000    
 C   -2.242500      -3.435400     -3.0800000E-02
 C   -1.912500       3.581400     -0.3742000    
 C    6.470500      0.3177000     -0.2058000    
 C   -3.693200      -4.554800      -1.546800    
 C   -3.918800       4.857500     -0.3259000    
 H    1.111900      -1.387100      -1.354300    
 H  -0.2074000      -2.207200       2.377500    
 H    1.104000       2.105600     -0.7064000    
 H    2.355300       1.194800       1.903600    
 H   -1.331800     -0.4824000      -1.423900    
 H   -2.417200      0.7342000       1.400800    
 H  -3.5500001E-02  0.9475000       2.592100    
 H    3.412500      -1.558400      -2.088000    
 H   -1.586900      -4.162600       1.892100    
 H  -7.1599998E-02   4.121900      -1.361700    
 H    4.625800       1.024900       1.173000    
 H   -2.685900      -2.396500      -1.909800    
 H   -3.596000       2.717400      0.7330000    
 H    7.436500      0.1265000     -0.6844000    
 H    6.303500       1.399600     -0.2436000    
 H    6.543200     -5.5399999E-02  0.8214000    
 H   -4.245200      -5.499200      -1.593900    
 H   -4.432400      -3.749000      -1.609600    
 H   -2.998600      -4.547800      -2.393700    
 H   -3.993300       4.909000      0.7656000    
 H   -4.281600       5.813900     -0.7166000    
 H   -4.558700       4.075700     -0.7491000    


%chk=000076380-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000076380

0 1
O 0.267641 0.379489 2.436233
O 5.303336 -0.139533 -1.561315
O -2.952228 -4.567299 0.175650
O -2.816499 5.122755 -0.360600
C 0.099078 0.291465 0.948073
C 1.498675 0.222390 0.297215
C -0.670052 -1.024827 0.721459
C -0.707726 1.532180 0.503222
C 1.762949 0.729809 -1.002363
C -1.477299 -1.574699 1.751336
C -0.087860 2.815431 0.531781
C 2.545952 -0.437724 0.982159
C -0.633405 -1.685840 -0.527064
C -2.078583 1.469737 0.168587
C 3.033610 0.593891 -1.592128
C -2.217835 -2.752081 1.540699
C -0.809941 3.984792 0.244024
C 3.828220 -0.580589 0.408425
C -1.377900 -2.864740 -0.759316
C -2.821230 2.634842 -0.131320
C 4.073131 -0.060981 -0.887463
C -2.174300 -3.401271 0.282116
C -2.186106 3.898920 -0.088756
C 6.407070 -0.812559 -0.873422
C -2.924991 -5.281178 -1.101950
C -4.239924 5.086898 -0.705345
H 0.971353 1.245337 -1.557287
H -1.500043 -1.074373 2.722548
H 0.981755 2.898596 0.761322
H 2.344526 -0.840393 1.979899
H -0.006564 -1.291381 -1.333588
H -2.581492 0.498374 0.137848
H 0.600543 1.290776 2.642420
H 3.243375 0.987367 -2.591510
H -2.834340 -3.186068 2.334038
H -0.334149 4.969976 0.263591
H 4.614574 -1.093473 0.970773
H -1.320691 -3.350273 -1.738192
H -3.880289 2.542488 -0.390136
H 7.256387 -0.756951 -1.570191
H 6.666321 -0.298140 0.072645
H 6.165469 -1.872899 -0.663649
H -3.586511 -6.148763 -0.961167
H -3.309629 -4.649422 -1.926767
H -1.902506 -5.628237 -1.349078
H -4.843503 4.665312 0.121870
H -4.521449 6.136858 -0.872592
H -4.416319 4.501310 -1.628634


