%chk=000149351.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149351

0 1
 O    5.381100      0.3685000     -0.1992000    
 O    2.298500       3.878200      0.3014000    
 O    3.134600      -4.235700     -0.5984000    
 O   -5.163300     -0.3904000      -1.330600    
 O   -4.834100       1.651600      -2.267900    
 C    1.902500       1.520900     -0.1221000    
 C    2.967900      0.4207000     -3.9999999E-04
 C    4.214800       1.044600     -0.6413000    
 C    4.215400       2.490300     -0.1496000    
 C   0.8055000       1.415800      0.9228000    
 C    2.747200       2.767500      4.6300001E-02
 C  -0.4109000       2.264000      0.5474000    
 C    2.553000     -0.8569000     -0.6571000    
 C   -1.496600       2.183400       1.622400    
 C    2.462600      -2.031000     -1.5400000E-02
 C   -2.743500       3.009900       1.293200    
 C    2.046500      -3.313200     -0.6801000    
 C   0.8348000      -3.970000     -4.8000002E-03
 C   -3.462300       2.642400     -8.0000004E-03
 C  -0.3882000      -3.051100      6.7199998E-02
 C   -4.009600       1.215600     -1.8500000E-02
 C   -1.573900      -3.674900      0.8106000    
 C   -2.819900      -2.788600      0.8232000    
 C   -4.700300      0.8871000      -1.322700    
 C   -3.961800      -3.448600       1.581500    
 H    1.487500       1.538900      -1.138400    
 H    3.183100      0.2308000       1.062100    
 H    4.171600       1.003800      -1.736900    
 H    4.743000       2.603700      0.8020000    
 H    4.641400       3.163400     -0.8976000    
 H   0.4809000      0.3731000       1.022500    
 H    1.182000       1.728400       1.905000    
 H  -0.8027000       1.901300     -0.4093000    
 H  -0.1299000       3.312200      0.4043000    
 H    2.311700     -0.8145000      -1.716800    
 H   -1.086200       2.546500       2.573100    
 H   -1.777600       1.137300       1.790200    
 H    6.147700      0.8435000     -0.5630000    
 H    2.707600      -2.081700       1.043000    
 H   -3.450100       2.921200       2.127800    
 H   -2.459500       4.068600       1.242300    
 H    1.824800      -3.157400      -1.742500    
 H   0.5789000      -4.891400     -0.5436000    
 H    1.111200      -4.292500       1.008300    
 H   -4.297100       3.342100     -0.1462000    
 H   -2.800200       2.801600     -0.8667000    
 H  -0.6974000      -2.787900     -0.9519000    
 H  -0.1320000      -2.113600      0.5733000    
 H   -1.272500      -3.893900       1.842700    
 H   -1.822100      -4.636100      0.3432000    
 H   -4.730500       1.086000      0.7959000    
 H   -3.193700      0.4965000      0.1053000    
 H    3.890100      -3.842700      -1.068400    
 H   -3.139000      -2.581200     -0.2046000    
 H   -2.584600      -1.825700       1.291200    
 H   -4.240700      -4.401100       1.119700    
 H   -3.683200      -3.639100       2.622800    
 H   -4.842500      -2.798700       1.578700    
 H   -5.609700     -0.6122000      -2.175500    


%chk=000149351-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000149351

0 1
O 5.585817 0.351230 -0.219687
O 2.427903 4.028738 0.275262
O 3.165639 -4.348112 -0.443586
O -5.873079 -0.404413 -0.532508
O -4.877993 0.989776 -2.098061
C 2.073723 1.586015 -0.079669
C 3.155658 0.461105 0.017203
C 4.401439 1.094026 -0.662398
C 4.375459 2.572707 -0.213135
C 0.904855 1.469174 0.926149
C 2.889475 2.891049 0.020624
C -0.343341 2.292949 0.535732
C 2.715110 -0.843903 -0.592900
C -1.468253 2.190715 1.591405
C 2.576313 -2.019674 0.072266
C -2.732437 3.018691 1.247017
C 2.112891 -3.306592 -0.571757
C 0.862203 -3.913092 0.090962
C -3.547256 2.513919 0.029565
C -0.393784 -3.025852 -0.043743
C -4.229560 1.155413 0.292368
C -1.656141 -3.664743 0.577078
C -2.892273 -2.739721 0.508470
C -4.986835 0.624234 -0.907262
C -4.172206 -3.374655 1.092507
H 1.648286 1.566903 -1.110633
H 3.418202 0.305154 1.083708
H 4.295739 1.030161 -1.768309
H 4.900534 2.665663 0.759562
H 4.834530 3.293785 -0.911765
H 0.627815 0.397750 1.007019
H 1.256712 1.785142 1.929283
H -0.712087 1.938612 -0.448867
H -0.052717 3.352734 0.407734
H 2.467142 -0.808623 -1.668239
H -1.070244 2.545618 2.563934
H -1.736271 1.123876 1.745827
H 6.385679 0.701635 -0.686788
H 2.827673 -2.085985 1.141835
H -3.398370 3.050974 2.134159
H -2.421861 4.065215 1.053922
H 1.903760 -3.118794 -1.649312
H 0.682078 -4.901420 -0.375370
H 1.087272 -4.100029 1.159478
H -4.324947 3.260561 -0.221230
H -2.904868 2.434400 -0.866390
H -0.586439 -2.811312 -1.116258
H -0.206485 -2.044434 0.439294
H -1.454265 -3.928396 1.636281
H -1.881847 -4.619093 0.057381
H -4.927032 1.214056 1.148777
H -3.482049 0.383726 0.565572
H 4.030493 -3.947580 -0.718124
H -3.072706 -2.450128 -0.547564
H -2.665658 -1.799696 1.055185
H -4.434923 -4.303143 0.550664
H -4.034475 -3.638723 2.158175
H -5.028732 -2.680269 1.017739
H -6.332966 -0.748021 -1.346683


