%chk=000177573.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000177573

0 1
 O  -0.9704000      8.2000000E-03  -1.404700    
 O    4.364500     -1.1200000E-02   1.900400    
 O    5.176500      7.9999998E-04 -0.1392000    
 N    4.205600     -3.7000000E-03  0.6558000    
 C   -2.004500      2.9000000E-03 -0.5152000    
 C   -2.533300      -1.207800     -6.7599997E-02
 C   -2.533700       1.208300     -5.3900000E-02
 C   -3.591200      -1.213100      0.8418000    
 C   -3.591700       1.202900      0.8553000    
 C   0.3148000      5.2000000E-03 -0.8931000    
 C   -4.120300     -7.7999998E-03   1.303500    
 C   -1.980300      -2.508500     -0.5493000    
 C   -1.982400       2.514500     -0.5223000    
 C   0.4952000     -3.1000001E-03  0.4789000    
 C    1.388800      1.1000000E-02  -1.765800    
 C    2.886300     -6.0000003E-04  0.1306000    
 C    1.791400     -6.0000001E-03  0.9949000    
 C    2.684900      8.1000002E-03  -1.249800    
 H   -4.012500      -2.148100       1.201800    
 H   -4.013500       2.133500       1.225500    
 H   -4.943100     -1.1900000E-02   2.012400    
 H   -1.816100      -2.489100      -1.632000    
 H   -1.034600      -2.731200     -4.5600001E-02
 H   -2.670600      -3.335800     -0.3508000    
 H   -1.034700       2.731100     -1.9600000E-02
 H   -2.671600       3.339600     -0.3114000    
 H   -1.822200       2.507600      -1.605600    
 H  -0.3058000     -7.6000001E-03   1.209300    
 H    1.233200      1.7600000E-02  -2.840500    
 H    1.911100     -1.2700000E-02   2.075400    
 H    3.513600      1.2800000E-02  -1.953300    


%chk=000177573-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000177573

0 1
O -0.944417 0.007130 -1.294285
O 4.640596 -0.009941 1.819996
O 5.344560 0.004046 -0.351960
N 4.412440 -0.002074 0.545870
C -2.072803 0.001999 -0.399848
C -2.626042 -1.250243 -0.036334
C -2.626240 1.250078 -0.022538
C -3.796280 -1.229645 0.763210
C -3.796465 1.220532 0.776733
C 0.352122 0.004258 -0.769524
C -4.375307 -0.006806 1.169452
C -1.991337 -2.548060 -0.495118
C -1.991747 2.552891 -0.467210
C 0.635733 -0.004481 0.621566
C 1.399475 0.010668 -1.727440
C 3.010744 0.000060 0.090828
C 1.974223 -0.006521 1.051415
C 2.734355 0.008584 -1.298344
H -4.253305 -2.180270 1.060727
H -4.253658 2.167751 1.084678
H -5.281800 -0.010272 1.784302
H -1.831332 -2.549214 -1.588071
H -1.000023 -2.703985 -0.028371
H -2.626929 -3.410107 -0.233187
H -1.000505 2.703929 0.001274
H -2.627502 3.411962 -0.196076
H -1.831645 2.565801 -1.560076
H -0.180987 -0.009639 1.349412
H 1.141813 0.017194 -2.790029
H 2.231098 -0.013130 2.113943
H 3.564566 0.013402 -2.009096


