%chk=000052000.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052000

0 1
 O   -2.544300      -2.008900      1.9999999E-04
 N  -0.2961000     -0.3164000      3.9999999E-04
 N    2.402100      -1.796400     -9.9999997E-05
 N    1.090500       1.639500      3.0000001E-04
 N    4.382600     -0.7736000     -3.0000001E-04
 N    3.526300       1.501700      9.9999997E-05
 C    2.128300     -0.4583000       0.000000    
 C   0.9695000      0.2929000      3.0000001E-04
 C   -1.610200      0.2009000     -1.9999999E-04
 C    3.373600      0.1555000     -1.9999999E-04
 C   -2.710500     -0.6562000     -9.9999997E-05
 C   -1.801800       1.582400     -1.9999999E-04
 C   -4.002900     -0.1316000     -9.9999997E-05
 C    3.765000      -1.935600     -1.9999999E-04
 C   -3.094400       2.107000     -1.9999999E-04
 C   -4.194900       1.250100     -9.9999997E-05
 C    2.343500       2.153600      3.0000001E-04
 C   -3.726300      -2.806500      1.9999999E-04
 H  -0.2666000      -1.332100       0.000000    
 H    1.726500      -2.549100      9.9999997E-05
 H   -1.007700       2.313800     -9.9999997E-05
 H   -4.905100     -0.7333000       0.000000    
 H    4.239200      -2.906700     -9.9999997E-05
 H   -3.245400       3.182700     -1.9999999E-04
 H   -5.200800       1.659900     -9.9999997E-05
 H    2.404000       3.236600      3.0000001E-04
 H   -4.316200      -2.655600     -0.9103000    
 H   -4.316200      -2.655300      0.9108000    
 H   -3.407300      -3.854100      3.0000001E-04


%chk=000052000-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000052000

0 1
O -2.385588 -1.901349 0.000126
N -0.367382 -0.256766 0.000200
N 2.316835 -1.913961 0.000175
N 1.092600 1.649689 -0.000056
N 4.371244 -0.901682 -0.000041
N 3.543908 1.442086 -0.000195
C 2.066558 -0.533938 0.000059
C 0.903505 0.295452 0.000056
C -1.639840 0.365374 0.000116
C 3.360040 0.082139 -0.000062
C -2.754307 -0.534970 0.000086
C -1.885447 1.758781 0.000088
C -4.076027 -0.054530 0.000032
C 3.710740 -2.067764 0.000089
C -3.216127 2.236934 0.000027
C -4.306515 1.343101 0.000000
C 2.379022 2.136926 -0.000192
C -3.454147 -2.899775 -0.000019
H -0.441340 -1.278453 0.000214
H 1.637591 -2.673475 0.000318
H -1.027825 2.433026 0.000093
H -4.922656 -0.747100 0.000015
H 4.182275 -3.048498 0.000139
H -3.393338 3.317409 0.000000
H -5.334359 1.720425 -0.000040
H 2.462888 3.227735 -0.000261
H -4.085230 -2.806939 -0.904530
H -4.085354 -2.807075 0.904419
H -2.947322 -3.875903 -0.000056


