%chk=000124034.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124034

0 1
 O    3.653200     -0.7837000     -0.6459000    
 O    3.103500       2.242700       1.356400    
 O    5.686600       1.223200       2.317300    
 O    7.144400     -5.4900002E-02  0.1851000    
 O    4.871200      -2.297100      -2.587800    
 O    1.942000      -2.055600      0.5636000    
 O    1.139000       2.430700     -0.8461000    
 O   -2.534700     -0.5576000      0.1519000    
 O   -1.356100       3.153700      -1.046600    
 O   -8.822300      -1.170700      0.4103000    
 C    3.628300      0.9437000       1.082600    
 C    5.155100       1.029500       1.005500    
 C    3.037800      0.4448000     -0.2452000    
 C    5.756200     -0.2561000      0.4380000    
 C    5.058500     -0.6532000     -0.8643000    
 C    1.544800      0.2003000     -0.1453000    
 C    5.566200      -1.990900      -1.392700    
 C   0.6458000       1.221000     -0.4566000    
 C    1.074500      -1.050400      0.2579000    
 C  -0.7269000      0.9815000     -0.3611000    
 C  -0.2974000      -1.285700      0.3516000    
 C   -1.198500     -0.2668000      4.1499998E-02
 C   -1.699200       2.036900     -0.6840000    
 C   -3.453800      0.4377000     -0.1433000    
 C   -3.124500       1.674900     -0.5472000    
 C    1.374600      -3.300300      0.9664000    
 C   -4.861700      1.6500000E-02  2.4000001E-03
 C   -5.849900      0.5792000     -0.8090000    
 C   -5.211100     -0.9471000      0.9515000    
 C   -7.179600      0.1809000     -0.6720000    
 C   -6.540800      -1.345600       1.088400    
 C   -7.525200     -0.7815000      0.2768000    
 H    3.339200      0.2917000       1.915900    
 H    5.470900       1.896900      0.4128000    
 H    3.221100       1.173600      -1.045900    
 H    5.671000      -1.057700       1.181900    
 H    5.221000      0.1026000      -1.644800    
 H    5.377500      -2.800700     -0.6801000    
 H    6.636600      -1.959000      -1.615100    
 H    3.354300       2.829600      0.6228000    
 H    5.277300       2.027600       2.679800    
 H    7.229600      0.6479000     -0.4816000    
 H  -0.7274000      -2.233400      0.6580000    
 H    3.921800      -2.320500      -2.378100    
 H   0.4202000       3.055700      -1.023900    
 H   -3.844500       2.454800     -0.7654000    
 H    2.207600      -3.981500       1.170100    
 H   0.7842000      -3.754300      0.1632000    
 H   0.8092000      -3.204200       1.899600    
 H   -5.618700       1.315000      -1.574700    
 H   -4.465900      -1.397100       1.602800    
 H   -7.941600      0.6199000      -1.310400    
 H   -6.797400      -2.095000       1.832300    
 H   -8.879400      -1.842100       1.111700    


%chk=000124034-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000124034

0 1
O 3.764161 -0.929883 -0.654941
O 3.080983 2.173501 1.415320
O 5.914810 1.680007 1.866961
O 7.297226 0.192372 -0.167596
O 4.939278 -2.539643 -2.578410
O 1.891874 -2.144445 0.909544
O 1.193636 2.302422 -0.766706
O -2.639303 -0.535509 0.192920
O -1.156493 3.146900 -1.103526
O -9.005841 -1.027417 0.325688
C 3.718922 0.913527 1.001409
C 5.199744 1.187746 0.685529
C 3.046301 0.292396 -0.255923
C 5.914453 -0.088496 0.226275
C 5.186166 -0.661959 -1.002435
C 1.566861 0.018101 -0.066452
C 5.731810 -2.015358 -1.464268
C 0.682540 1.067987 -0.390521
C 0.994595 -1.186896 0.455247
C -0.738730 0.912915 -0.328005
C -0.413781 -1.375314 0.526756
C -1.248076 -0.326562 0.120036
C -1.635415 1.998661 -0.701301
C -3.526918 0.492625 -0.171960
C -3.051530 1.721995 -0.600978
C 1.363176 -3.416055 1.418378
C -4.934160 0.085583 -0.035728
C -5.994921 0.981898 -0.360566
C -5.270499 -1.218601 0.423060
C -7.335898 0.594358 -0.233763
C -6.612278 -1.617649 0.553977
C -7.649108 -0.709330 0.224576
H 3.634882 0.222563 1.859134
H 5.252143 1.945686 -0.129412
H 3.134551 1.040468 -1.077343
H 5.886940 -0.825486 1.058477
H 5.228760 0.071717 -1.836924
H 5.729768 -2.721256 -0.605893
H 6.761413 -1.896854 -1.833733
H 2.568249 2.554760 0.646230
H 5.375365 2.422651 2.245061
H 7.696916 0.741617 0.556325
H -0.859416 -2.298756 0.899225
H 3.987590 -2.449951 -2.307132
H 0.355300 2.911587 -1.001084
H -3.743723 2.517657 -0.879101
H 2.253995 -3.997947 1.693741
H 0.792834 -3.952233 0.636574
H 0.727374 -3.258035 2.310458
H -5.777699 1.993189 -0.717006
H -4.469270 -1.917297 0.675210
H -8.152681 1.277463 -0.482024
H -6.850697 -2.628201 0.908960
H -9.139583 -1.953423 0.648660


