%chk=000089523.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089523

0 1
 O   -7.735700     -0.5712000      5.7100002E-02
 N    1.130700     -0.1527000      0.1095000    
 N   -1.649600      0.4841000     -0.1905000    
 C   0.7129000       1.211200     -0.2690000    
 C  -0.7049000       1.520200      0.2379000    
 C    1.678400       2.245600      0.3130000    
 C   0.1377000      -1.220500     -6.8000004E-02
 C   -1.254300     -0.7955000      0.4022000    
 C    3.073000       2.012700     -0.2376000    
 C    2.503000     -0.4571000      4.0100001E-02
 C    3.473600      0.5665000     -9.9600002E-02
 C   -3.012000      0.8349000      0.2102000    
 C   -3.998100     -0.2260000     -0.2756000    
 C    2.994600      -1.776000      0.1353000    
 C    4.846500      0.2631000     -0.1703000    
 C   -5.429900      0.1259000      0.1250000    
 C    4.362300      -2.069200      7.6600000E-02
 C    5.289000      -1.050000     -7.8500003E-02
 C   -6.416900     -0.9461000     -0.3177000    
 H   0.7169000       1.283000      -1.366200    
 H  -0.7071000       1.614400       1.333000    
 H   -1.012600       2.492200     -0.1691000    
 H    1.697900       2.168400       1.408700    
 H    1.354000       3.263500      6.6799998E-02
 H   0.3903000      -2.108200      0.5202000    
 H   0.1055000      -1.510700      -1.126000    
 H   -1.906500      -1.619500      0.1037000    
 H   -1.272900     -0.7415000       1.499300    
 H    3.779600       2.657700      0.2979000    
 H    3.107800       2.284800      -1.299700    
 H   -3.089400      0.9478000       1.299600    
 H   -3.288500       1.798000     -0.2370000    
 H   -3.800100      -1.206500      0.1655000    
 H   -3.933600     -0.3322000      -1.365600    
 H    2.330200      -2.626500      0.2549000    
 H    5.576500       1.059200     -0.2972000    
 H   -5.720300       1.089700     -0.3115000    
 H   -5.502000      0.2553000       1.212300    
 H    4.696500      -3.100300      0.1508000    
 H    6.349400      -1.275700     -0.1294000    
 H   -6.390300      -1.071300      -1.405000    
 H   -6.184400      -1.906500      0.1538000    
 H   -8.330000      -1.279700     -0.2438000    


%chk=000089523-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000089523

0 1
O -7.909388 -0.250981 -0.076779
N 1.208998 -0.177701 0.154367
N -1.653115 0.320308 -0.027508
C 0.695694 1.158192 -0.253860
C -0.709458 1.403464 0.329784
C 1.659396 2.262786 0.218481
C 0.244335 -1.280913 -0.044165
C -1.140777 -0.949292 0.533549
C 3.054266 2.055163 -0.393570
C 2.601996 -0.439957 0.047232
C 3.538361 0.626356 -0.180689
C -3.043103 0.634853 0.391146
C -4.097377 -0.307063 -0.225476
C 3.123599 -1.762754 0.188123
C 4.920591 0.344425 -0.219897
C -5.535829 0.147223 0.110499
C 4.508780 -2.017494 0.134617
C 5.427539 -0.964410 -0.066066
C -6.596331 -0.785940 -0.478971
H 0.609565 1.198910 -1.366155
H -0.617371 1.517422 1.442226
H -1.091636 2.357439 -0.079130
H 1.720311 2.234300 1.323452
H 1.249836 3.248566 -0.072879
H 0.606261 -2.186717 0.467834
H 0.137792 -1.518582 -1.127453
H -1.827636 -1.773844 0.274536
H -1.070231 -0.895848 1.651687
H 3.779632 2.767238 0.043012
H 3.012465 2.279463 -1.479824
H -3.147659 0.627551 1.508455
H -3.259807 1.668817 0.057696
H -3.950051 -1.342763 0.141206
H -3.944226 -0.328588 -1.322310
H 2.454475 -2.612506 0.345024
H 5.614726 1.179617 -0.382842
H -5.713530 1.169360 -0.276444
H -5.678640 0.188707 1.208079
H 4.865726 -3.047579 0.250607
H 6.504700 -1.156193 -0.105073
H -6.504020 -0.816275 -1.587017
H -6.454445 -1.818053 -0.088453
H -8.627214 -0.821406 -0.450948


