%chk=000106417.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000106417

0 1
 O    2.676900      -2.484000      5.1899999E-02
 C   -3.156600       1.498400      -1.028000    
 C   -1.949200       2.100600     -0.3052000    
 C   -4.140800      0.8792000     -3.3100002E-02
 C  -0.9123000       2.718700      -1.249100    
 C   -5.379500      0.2665000     -0.6971000    
 C   0.3044000       3.365500     -0.5788000    
 C   -6.376200     -0.4308000      0.2490000    
 C    1.154700       2.382000      0.2282000    
 C    2.397000       3.067900      0.8067000    
 C    3.291600       2.109600       1.601600    
 C   -7.036300      0.5422000       1.226500    
 C   -5.660500      -1.539700       1.025700    
 C    3.756400      0.9154000      0.8052000    
 C    2.989800     -0.2395000      0.8014000    
 C    4.941700      0.9943000      9.0899996E-02
 C    3.419300      -1.343400      6.4700000E-02
 C    5.371200     -0.1096000     -0.6457000    
 C    4.610000      -1.278400     -0.6588000    
 C    1.308500      -2.359500     -0.1210000    
 C   0.8277000      -1.506900      -1.098200    
 C   0.4579000      -3.090900      0.6881000    
 C  -0.5505000      -1.381500      -1.272400    
 C  -0.9204000      -2.965500      0.5138000    
 C   -1.424700      -2.110900     -0.4664000    
 H   -2.825600      0.7383000      -1.743400    
 H   -3.663700       2.281200      -1.604500    
 H   -2.293100       2.870000      0.3971000    
 H   -1.474100       1.315600      0.2938000    
 H   -3.606200      0.1148000      0.5402000    
 H   -4.454700       1.650500      0.6798000    
 H  -0.5628000       1.949100      -1.948500    
 H   -1.409300       3.484000      -1.858700    
 H   -5.046700     -0.4630000      -1.447200    
 H   -5.909500       1.051500      -1.251800    
 H  -3.5300002E-02   4.177600      7.5499997E-02
 H   0.9238000       3.825500      -1.358800    
 H   -7.161800     -0.8866000     -0.3665000    
 H   0.5677000       1.951600       1.046500    
 H    1.440400       1.569200     -0.4457000    
 H    2.091500       3.892800       1.461600    
 H    2.979000       3.509800     -1.2000000E-02
 H    2.755700       1.764700       2.495700    
 H    4.162900       2.659800       1.979600    
 H   -7.799900      2.8800000E-02   1.820800    
 H   -7.526400       1.359400      0.6873000    
 H   -6.312800      0.9784000       1.922500    
 H   -6.392000      -2.150100       1.567400    
 H   -5.113200      -2.205500      0.3501000    
 H   -4.960100      -1.144400       1.768000    
 H    2.079100     -0.2834000       1.393200    
 H    5.540000       1.900800      9.3099996E-02
 H    6.297900     -5.8800001E-02  -1.209800    
 H    4.949500      -2.134800      -1.235000    
 H    1.487000     -0.9473000      -1.755200    
 H   0.8490000      -3.756300       1.451700    
 H  -0.9398000     -0.7266000      -2.045400    
 H   -1.601100      -3.533900       1.140800    
 H   -2.497600      -2.017000     -0.6056000    


%chk=000106417-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000106417

0 1
O 2.641274 -2.545741 0.073955
C -3.161609 1.835674 -1.026863
C -1.921441 2.399048 -0.296737
C -4.121560 1.060292 -0.095678
C -0.929248 3.107677 -1.248148
C -5.353152 0.498096 -0.844593
C 0.309463 3.716937 -0.545946
C -6.310118 -0.398751 -0.006442
C 1.185074 2.672042 0.185276
C 2.539842 3.237141 0.664343
C 3.380034 2.227303 1.503524
C -6.907811 0.352431 1.208165
C -5.635586 -1.720360 0.437628
C 3.788304 0.984914 0.723151
C 2.995433 -0.188654 0.769745
C 4.955715 0.987161 -0.085341
C 3.357826 -1.320699 0.005369
C 5.319093 -0.158159 -0.829015
C 4.520709 -1.322505 -0.793174
C 1.225422 -2.561092 0.140548
C 0.410462 -1.589560 -0.488226
C 0.653082 -3.672292 0.799463
C -0.993861 -1.736025 -0.438122
C -0.751761 -3.806752 0.836544
C -1.582661 -2.839156 0.223261
H -2.827527 1.163939 -1.847170
H -3.712017 2.665909 -1.517496
H -2.248271 3.111346 0.490078
H -1.408919 1.567976 0.228648
H -3.560058 0.234594 0.387120
H -4.452367 1.731779 0.721930
H -0.586248 2.382826 -2.016992
H -1.467928 3.908735 -1.795627
H -5.000018 -0.088076 -1.719491
H -5.935395 1.349305 -1.256190
H -0.018463 4.494030 0.176185
H 0.930488 4.238027 -1.303976
H -7.153746 -0.669699 -0.677381
H 0.635056 2.268525 1.059597
H 1.364957 1.813374 -0.492961
H 2.361773 4.140655 1.283198
H 3.133043 3.566135 -0.213143
H 2.789650 1.934437 2.393729
H 4.285812 2.745278 1.874019
H -7.675710 -0.262703 1.713545
H -7.382556 1.302509 0.897845
H -6.127592 0.590710 1.954889
H -6.362676 -2.383325 0.942864
H -5.223736 -2.268165 -0.431997
H -4.808558 -1.532001 1.148049
H 2.102947 -0.221908 1.404137
H 5.583436 1.885472 -0.123072
H 6.227813 -0.147380 -1.441120
H 4.780938 -2.221416 -1.359545
H 0.862816 -0.743544 -1.014945
H 1.313847 -4.409194 1.265811
H -1.627068 -0.988381 -0.929507
H -1.196642 -4.667992 1.347211
H -2.672103 -2.945348 0.255572


