%chk=000158345.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000158345

0 1
 O    5.144700      -1.794700     -6.6100001E-02
 O  -5.7399999E-02   3.724400      0.3750000    
 N   -1.764400       1.538200     -7.3700003E-02
 N    4.042500     -0.9539000     -4.8999999E-02
 C  -0.7831000     -0.5780000      2.0000000E-02
 C   0.2925000      -1.379900      9.0499997E-02
 C  -0.6184000      0.9075000     -4.4300001E-02
 C    1.629300     -0.7555000      2.4300000E-02
 C   -2.233100     -0.7718000      5.5000000E-03
 C    1.817200      0.7395000     -2.7000001E-02
 C   0.7254000       1.538700     -5.8200002E-02
 C   -2.756300      0.5340000     -4.3299999E-02
 C   0.2200000      -2.875600      0.2494000    
 C    2.768200      -1.491300     -6.0000003E-04
 C    3.196100       1.273000     -4.9199998E-02
 C   -3.082200      -1.864600     -3.8999999E-03
 C   -4.124400      0.7634000     -7.4500002E-02
 C    4.224500      0.4101000     -6.2700003E-02
 C   0.8026000       3.012300     -0.1130000    
 C   -4.463000      -1.639200     -3.4100000E-02
 C   -4.980800     -0.3367000     -6.5200001E-02
 H   0.5404000      -3.377200     -0.6698000    
 H  -0.7759000      -3.238500      0.4953000    
 H   0.8557000      -3.211200       1.077000    
 H    2.788300      -2.574400      1.6000001E-02
 H    3.395200       2.336500     -4.3600000E-02
 H   -2.724100      -2.885300     -1.9999999E-04
 H   -4.523700       1.771500     -0.1104000    
 H    5.257600      0.7357000     -7.8299999E-02
 H    1.689900       3.443800     -0.5994000    
 H   -5.144800      -2.485900     -3.8800001E-02
 H   -6.056400     -0.1854000     -9.0499997E-02
 H    5.277100      -1.934700      -1.019600    


%chk=000158345-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000158345

0 1
O 5.192463 -1.834609 0.169109
O -0.043758 3.949835 -0.072602
N -1.838615 1.615461 -0.107161
N 4.058884 -0.960702 -0.021527
C -0.766500 -0.499473 0.001637
C 0.330533 -1.348865 0.007891
C -0.638823 0.991914 -0.063952
C 1.652159 -0.731730 -0.013461
C -2.206886 -0.744179 0.012508
C 1.805507 0.745488 -0.052895
C 0.671180 1.602998 -0.096259
C -2.803372 0.571432 -0.057253
C 0.131579 -2.853395 0.037482
C 2.808368 -1.525574 0.011524
C 3.167637 1.243902 0.010095
C -3.033206 -1.891188 0.077420
C -4.203356 0.733909 -0.068030
C 4.268231 0.412789 0.033131
C 0.847071 3.069652 -0.209808
C -4.437499 -1.721225 0.066600
C -5.013594 -0.423691 -0.006625
H -0.539714 -3.164216 -0.783545
H -0.351163 -3.161562 0.984012
H 1.058966 -3.437629 -0.063268
H 2.800080 -2.613300 0.062671
H 3.363257 2.315344 0.065310
H -2.617574 -2.901496 0.142136
H -4.634590 1.738110 -0.121062
H 5.303503 0.745299 0.107185
H 1.886686 3.395726 -0.472004
H -5.089959 -2.599908 0.117597
H -6.104972 -0.320934 -0.012605
H 5.556678 -2.003381 -0.746652


