%chk=000039668.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039668

0 1
 O  -0.8890000      -2.485000       1.028300    
 O    4.484200      0.6467000      0.1273000    
 O    1.203000       3.033400     -0.2860000    
 O    3.281100       2.748100      -1.161800    
 C   -1.733000      -1.061200     -0.7450000    
 C   -2.652900      -2.221900      -1.187300    
 C   -2.519900      8.6099997E-02 -0.1351000    
 C  -0.6631000      -1.577700      0.2291000    
 C   0.7052000     -0.9857000      0.2024000    
 C   -1.902500      -3.357900      -1.872000    
 C    1.774800      -1.776800      0.5569000    
 C   -3.041000       1.057800     -0.9671000    
 C   -2.692500      0.1262000       1.234700    
 C   0.8481000      0.3303000     -0.1767000    
 C    3.054800      -1.223000      0.5309000    
 C    2.128000      0.8841000     -0.2027000    
 C    3.231400      0.1074000      0.1510000    
 C   -3.763400       2.111400     -0.4069000    
 C   -3.415000       1.179900       1.794800    
 C    4.223600      -2.070600      0.9121000    
 C   -3.950400       2.172400      0.9739000    
 C    2.288500       2.276100     -0.6007000    
 H   -1.213700     -0.7035000      -1.644800    
 H   -3.200000      -2.626500     -0.3262000    
 H   -3.411500      -1.839400      -1.882100    
 H   -2.612500      -4.108300      -2.234800    
 H   -1.335200      -2.988000      -2.732100    
 H   -1.209300      -3.862200      -1.193200    
 H    1.636100      -2.814800      0.8462000    
 H   -2.900600       1.016800      -2.043000    
 H   -2.312700     -0.6341000       1.907000    
 H  -2.4999999E-03  0.9388000     -0.4564000    
 H   -4.180700       2.884100      -1.046000    
 H   -3.565100       1.225400       2.869500    
 H    3.914900      -3.086500       1.183100    
 H    4.924400      -2.161300      7.5499997E-02
 H    4.739000      -1.649800       1.781800    
 H   -4.513900       2.992100       1.409900    
 H    5.154100     -1.1000000E-03  0.3946000    
 H    1.318800       3.968600     -0.5584000    


%chk=000039668-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000039668

0 1
O -0.806716 -2.762821 0.647436
O 4.532130 0.782713 0.204584
O 1.322460 2.490785 -2.050511
O 3.503746 2.812846 -1.337588
C -1.788066 -1.080531 -0.827857
C -2.792057 -2.171791 -1.294770
C -2.480576 -0.008524 0.030128
C -0.625145 -1.697873 -0.018914
C 0.707050 -1.012188 0.010819
C -2.189184 -3.139570 -2.334611
C 1.755690 -1.615441 0.761375
C -2.669693 1.305236 -0.467607
C -2.977260 -0.330401 1.320377
C 0.972309 0.201116 -0.659527
C 3.033288 -1.044633 0.845679
C 2.246966 0.818974 -0.602876
C 3.279481 0.185422 0.153834
C -3.347808 2.277422 0.302030
C -3.652808 0.640859 2.091140
C 4.146395 -1.696739 1.646896
C -3.841693 1.948405 1.585146
C 2.474959 2.101557 -1.320172
H -1.377993 -0.588533 -1.730282
H -3.131497 -2.741782 -0.410832
H -3.678259 -1.661627 -1.718430
H -2.943525 -3.874698 -2.668945
H -1.829001 -2.596409 -3.229372
H -1.340820 -3.701503 -1.905593
H 1.531479 -2.553842 1.280862
H -2.291213 1.568584 -1.463553
H -2.826256 -1.340345 1.719361
H 0.200015 0.711457 -1.236556
H -3.488909 3.288022 -0.097817
H -4.030068 0.379473 3.086393
H 3.792073 -2.635692 2.100863
H 5.022700 -1.956690 1.018523
H 4.498528 -1.052384 2.477951
H -4.365543 2.701745 2.184128
H 5.156613 0.244675 0.756127
H 1.527807 3.355129 -2.497140


