%chk=000139499.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000139499

0 1
 O  -7.2300002E-02  -1.124100      0.6748000    
 O   -5.595200       1.766600     -4.8200000E-02
 O   -6.046900     -0.1645000     -0.9896000    
 N   -5.255500      0.6111000     -0.4007000    
 C    4.712800     -0.3712000     -0.1744000    
 C    3.399400      0.2622000      0.2892000    
 C    5.893400      0.6042000     -0.1718000    
 C    2.262700     -0.7590000      0.2896000    
 C    7.220500     -4.6300001E-02 -0.5642000    
 C   0.9419000     -0.1295000      0.7093000    
 C    8.371000      0.9452000     -0.4767000    
 C   -1.348100     -0.6976000      0.4114000    
 C   -1.740200      0.5790000      0.7972000    
 C   -2.236100      -1.545900     -0.2398000    
 C   -3.038100       1.013300      0.5280000    
 C   -3.534000      -1.111600     -0.5090000    
 C   -3.935100      0.1680000     -0.1252000    
 H    4.950900      -1.220500      0.4782000    
 H    4.585600     -0.7758000      -1.186200    
 H    3.146600       1.099300     -0.3727000    
 H    3.525100      0.6734000       1.298000    
 H    5.990100       1.040200      0.8305000    
 H    5.677000       1.433100     -0.8572000    
 H    2.151200      -1.202400     -0.7080000    
 H    2.499900      -1.592000      0.9632000    
 H    7.153500     -0.4379000      -1.585600    
 H    7.427900     -0.8956000      9.6900001E-02
 H   0.7273000      0.6924000      1.3700000E-02
 H    1.022200      0.2670000       1.728200    
 H    8.207500       1.795500      -1.146600    
 H    9.310000      0.4619000     -0.7639000    
 H    8.483600       1.327100      0.5430000    
 H   -1.082100       1.256800       1.332200    
 H   -1.927000      -2.542800     -0.5406000    
 H   -3.317800       2.014300      0.8468000    
 H   -4.205300      -1.797200      -1.019900    


%chk=000139499-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000139499

0 1
O -0.112069 -0.900544 -0.243622
O -5.944653 1.512981 0.789959
O -6.445592 -0.639336 0.214888
N -5.600467 0.317128 0.431511
C 4.850164 -0.349872 -0.262633
C 3.491943 0.350134 -0.029509
C 6.062881 0.575983 -0.018893
C 2.290867 -0.597034 -0.258013
C 7.420221 -0.128821 -0.245009
C 0.954846 0.103818 -0.011302
C 8.629374 0.795590 0.013469
C -1.435778 -0.521043 -0.059720
C -1.853324 0.781447 0.331707
C -2.398592 -1.542779 -0.290946
C -3.223883 1.052898 0.491822
C -3.763477 -1.272898 -0.131727
C -4.167005 0.027918 0.260734
H 4.924537 -1.233812 0.404439
H 4.888216 -0.739540 -1.301123
H 3.412879 1.227123 -0.705376
H 3.461790 0.748376 1.006330
H 6.024312 0.967851 1.019222
H 5.994307 1.459574 -0.687589
H 2.307497 -0.986628 -1.293717
H 2.366449 -1.470941 0.416806
H 7.462296 -0.513427 -1.284525
H 7.483318 -1.016384 0.417304
H 0.811518 0.954630 -0.708380
H 0.883914 0.475302 1.031551
H 8.606920 1.675836 -0.656601
H 9.585959 0.267797 -0.155105
H 8.628339 1.168057 1.055366
H -1.126295 1.577662 0.510314
H -2.045575 -2.533150 -0.591682
H -3.576687 2.043121 0.792063
H -4.522750 -2.040316 -0.302114


