%chk=000043317.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043317

0 1
 O    3.286200      -1.540100      0.2423000    
 N    2.743900      0.7545000      0.2229000    
 C    5.030500      7.5900003E-02  0.3268000    
 C    5.721500      0.3831000     -0.9486000    
 C    6.055600     -0.8651000     -0.1856000    
 C    3.584900     -0.3508000      0.2598000    
 C  -0.6951000     -0.4948000      6.5200001E-02
 C   -1.635400      -1.681200      2.2399999E-02
 C   -1.423900      0.7154000      3.3300001E-02
 C    1.350000      0.7234000      0.1588000    
 C   -2.987300      -1.001500     -3.7900001E-02
 C   -2.835500      0.4033000     -2.9999999E-02
 C   0.6872000     -0.5048000      0.1276000    
 C  -0.7661000       1.933700      6.4000003E-02
 C   0.6307000       1.930500      0.1273000    
 C   -4.237000      -1.593300     -9.3400002E-02
 C   -3.944900       1.231000     -7.8299999E-02
 C   -5.355000     -0.7586000     -0.1421000    
 C   -5.210400      0.6394000     -0.1345000    
 H    5.296900      0.6672000       1.196800    
 H    6.451500       1.183300     -0.9502000    
 H    5.179300      0.2728000      -1.879800    
 H    5.753400      -1.809500     -0.6209000    
 H    7.010500     -0.9012000      0.3253000    
 H    3.171100       1.677800      0.2434000    
 H   -1.543600      -2.281300      0.9323000    
 H   -1.462500      -2.280500     -0.8763000    
 H    1.156200      -1.475600      0.1485000    
 H   -1.307700       2.873400      4.0500000E-02
 H    1.156500       2.882600      0.1521000    
 H   -4.350200      -2.671600     -9.9100001E-02
 H   -3.849300       2.311700     -7.2999999E-02
 H   -6.350100      -1.193300     -0.1862000    
 H   -6.096200       1.268200     -0.1729000    


%chk=000043317-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000043317

0 1
O 3.422997 -1.341206 -0.366015
N 2.742741 0.872964 0.052002
C 5.122401 0.370547 -0.086696
C 6.151133 -0.332474 -1.004887
C 6.179284 -0.600713 0.492023
C 3.703800 -0.121083 -0.148531
C -0.756423 -0.475776 -0.131584
C -1.706512 -1.650456 -0.336603
C -1.505040 0.715091 0.114003
C 1.322777 0.758894 0.060615
C -3.081936 -1.009972 -0.182380
C -2.941657 0.387969 0.083380
C 0.646055 -0.473833 -0.162067
C -0.827639 1.935159 0.333273
C 0.580457 1.950734 0.305452
C -4.356826 -1.595501 -0.265729
C -4.083317 1.200468 0.266121
C -5.502438 -0.779455 -0.082097
C -5.364169 0.606414 0.181494
H 5.274245 1.439359 0.102091
H 6.933325 0.288937 -1.449252
H 5.747057 -1.121720 -1.644239
H 5.793538 -1.565550 0.831775
H 6.981293 -0.167453 1.095732
H 3.103412 1.815429 0.217839
H -1.535631 -2.451630 0.408982
H -1.574647 -2.116292 -1.332892
H 1.229518 -1.377528 -0.348048
H -1.378809 2.862522 0.523446
H 1.115719 2.894343 0.475249
H -4.470906 -2.666725 -0.469114
H -3.985252 2.272883 0.470386
H -6.502812 -1.222476 -0.144156
H -6.260037 1.222127 0.320930


