%chk=000074297.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000074297

0 1
 O   -4.676400     -8.9800000E-02 -0.3991000    
 O   -3.625500     -1.1900000E-02   1.652700    
 O   -6.383600       2.070900     -0.8949000    
 O   -6.815600      -2.165100     -0.3491000    
 C    2.738200     -0.1425000     -0.4309000    
 C    3.998300     -0.1040000      0.4358000    
 C    1.473800     -3.9200000E-02  0.4251000    
 C    5.298000     -0.1114000     -0.3747000    
 C   0.2113000     -0.1105000     -0.4363000    
 C    6.595000      1.3900000E-02  0.4327000    
 C   -1.053000     -4.1299999E-02  0.4262000    
 C    7.852300      6.1299998E-02 -0.4392000    
 C   -2.332700     -0.1383000     -0.4043000    
 C    9.150300      9.6000001E-02  0.3720000    
 C    10.40570      0.1144000     -0.4861000    
 C   -3.592000     -8.1100002E-02  0.4318000    
 C   -5.949900     -9.3000000E-03  0.2491000    
 C   -6.335600       1.458900      0.3898000    
 C   -6.958600     -0.7711000     -0.6006000    
 H    2.760800      0.6852000      -1.150000    
 H    2.722500      -1.073900      -1.009500    
 H    3.998300     -0.9605000       1.120900    
 H    3.979000      0.7989000       1.058800    
 H    1.483700      0.9031000      0.9862000    
 H    1.462600     -0.8533000       1.160100    
 H    5.337800      -1.035300     -0.9656000    
 H    5.261200      0.7143000      -1.097000    
 H   0.2091000      0.7148000      -1.158500    
 H   0.2100000      -1.044600      -1.011000    
 H    6.550300      0.9209000       1.047800    
 H    6.663200     -0.8346000       1.124400    
 H   -1.037500     -0.8534000       1.164200    
 H   -1.058100      0.8965000      0.9958000    
 H    7.866600     -0.8172000      -1.096200    
 H    7.807800      0.9428000      -1.090500    
 H   -2.339800      -1.083500     -0.9588000    
 H   -2.362700      0.6916000      -1.119800    
 H    9.188600     -0.7785000       1.032600    
 H    9.149500      0.9819000       1.018300    
 H    10.42130      0.9957000      -1.135000    
 H    10.45970     -0.7781000      -1.117500    
 H    11.29870      0.1399000      0.1460000    
 H   -5.910000     -0.4765000       1.241400    
 H   -5.591200       1.998900      0.9834000    
 H   -7.314800       1.565300      0.8673000    
 H   -6.798700     -0.6015000      -1.670400    
 H   -7.984900     -0.4968000     -0.3366000    
 H   -6.630700       3.001300     -0.7578000    
 H   -7.472200      -2.623100     -0.9010000    


%chk=000074297-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000074297

0 1
O -4.751149 -0.068778 -0.409906
O -3.714172 0.416239 1.623283
O -7.022686 1.861780 -0.906530
O -6.651914 -2.318757 -0.263546
C 2.784097 0.006275 -0.427126
C 4.077328 -0.002124 0.418794
C 1.495414 0.030051 0.425172
C 5.366370 -0.021773 -0.433364
C 0.202660 0.032958 -0.421309
C 6.660176 -0.031156 0.411983
C -1.079641 0.068818 0.438445
C 7.949192 -0.048945 -0.440351
C -2.358445 0.050842 -0.421007
C 9.243368 -0.057696 0.405312
C 10.525600 -0.074851 -0.454951
C -3.633189 0.155343 0.398995
C -6.084018 -0.044897 0.268023
C -6.593998 1.389761 0.419018
C -7.005141 -0.924939 -0.569357
H 2.793807 0.888186 -1.101686
H 2.771882 -0.887644 -1.085617
H 4.069323 -0.885431 1.091326
H 4.088570 0.890104 1.079460
H 1.505654 0.925713 1.080808
H 1.487461 -0.849400 1.102363
H 5.354849 -0.913578 -1.094696
H 5.374602 0.862086 -1.105338
H 0.215492 0.909086 -1.103711
H 0.190534 -0.867155 -1.071415
H 6.671332 0.860030 1.074187
H 6.652736 -0.915655 1.083109
H -1.090599 -0.795160 1.130857
H -1.080296 0.971886 1.078139
H 7.939868 -0.940351 -1.102325
H 7.957892 0.835354 -1.111803
H -2.417026 -0.867156 -1.035894
H -2.353079 0.893164 -1.142515
H 9.233754 -0.941582 1.075527
H 9.251452 0.832824 1.066732
H 10.573622 0.814778 -1.111212
H 10.554610 -0.970702 -1.103842
H 11.436232 -0.081990 0.172159
H -5.960378 -0.481479 1.276673
H -5.789605 2.020423 0.844695
H -7.450526 1.381468 1.127985
H -6.870551 -0.678226 -1.638843
H -8.057891 -0.717271 -0.286787
H -7.193017 2.834896 -0.873058
H -6.940453 -2.905170 -1.004858


