%chk=000155509.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155509

0 1
 O   -2.124200     -3.8300000E-02 -0.4647000    
 O   -3.050600       1.223100       1.235600    
 N    2.158900     -0.5046000      0.5520000    
 C    1.664300      3.6499999E-02 -0.7349000    
 C   0.1831000     -0.3581000     -0.9958000    
 C    1.852500       1.565500     -0.8002000    
 C   3.3199999E-02  -1.885400     -0.9250000    
 C    2.028900      -1.971600      0.6030000    
 C    3.566100     -0.1384000      0.7918000    
 C   0.5918000      -2.436700      0.3808000    
 C    3.302600       1.963800     -0.5557000    
 C    3.784400       1.372400      0.7608000    
 C  -0.8212000      0.3222000     -5.4400001E-02
 C   -3.154000      0.4835000      0.2698000    
 C   -4.426400     -2.2000000E-03 -0.3032000    
 C   -5.589300      0.3681000      0.2403000    
 H    2.264500     -0.4006000      -1.547500    
 H  -7.6200001E-02 -6.1999999E-02  -2.022000    
 H    1.242500       2.070000     -4.2700000E-02
 H    1.530800       1.941200      -1.778600    
 H   0.5842000      -2.333700      -1.762400    
 H   -1.010100      -2.196800      -1.046500    
 H    2.354600      -2.336000       1.585100    
 H    2.678500      -2.442300     -0.1473000    
 H    4.220800     -0.6118000      4.7699999E-02
 H    3.877800     -0.5058000       1.777300    
 H  -3.6200002E-02  -2.130900       1.225400    
 H   0.5644000      -3.532300      0.3541000    
 H    3.394400       3.055300     -0.5334000    
 H    3.930800       1.602500      -1.379000    
 H    4.848300       1.595600      0.8991000    
 H    3.247500       1.840900       1.595300    
 H  -0.7429000       1.410600     -0.1329000    
 H  -0.6600000      3.7700001E-02  0.9908000    
 H   -4.399800     -0.6592000      -1.165300    
 H   -6.523300      1.0900000E-02 -0.1810000    
 H   -5.647700       1.023500       1.102200    


%chk=000155509-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000155509

0 1
O -2.143346 -0.119604 -0.448298
O -3.023266 1.389718 1.106715
N 2.127467 -0.498030 0.543773
C 1.685416 0.052978 -0.775219
C 0.205730 -0.342924 -1.073768
C 1.911581 1.583081 -0.835205
C 0.053505 -1.884807 -1.025104
C 1.987952 -1.980582 0.599971
C 3.535615 -0.130745 0.864400
C 0.546978 -2.444094 0.325645
C 3.378662 1.958281 -0.543870
C 3.776171 1.388384 0.834628
C -0.769208 0.366836 -0.118925
C -3.192470 0.487045 0.249600
C -4.490849 -0.097484 -0.181254
C -5.664849 0.323278 0.356242
H 2.304862 -0.409267 -1.595342
H -0.021049 0.002369 -2.103061
H 1.272524 2.081124 -0.081738
H 1.597293 1.947790 -1.832923
H 0.660337 -2.323832 -1.843624
H -0.998077 -2.166126 -1.208203
H 2.315211 -2.314188 1.603220
H 2.671134 -2.466616 -0.149012
H 4.243280 -0.617575 0.139233
H 3.768796 -0.536517 1.867314
H -0.112908 -2.107251 1.146796
H 0.515237 -3.550436 0.318064
H 3.509392 3.056593 -0.569174
H 4.040469 1.532527 -1.326527
H 4.841045 1.592867 1.057013
H 3.169538 1.871620 1.624876
H -0.764991 1.462653 -0.247090
H -0.554029 0.143190 0.940038
H -4.443651 -0.878319 -0.947580
H -6.624129 -0.103073 0.044835
H -5.672373 1.107737 1.122156


