%chk=000059725.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059725

0 1
 O    2.936400      2.8000001E-02 -0.9596000    
 O    1.208600       2.790100       1.605200    
 O    1.006400      -2.804800      -1.677900    
 O   -1.169600      0.2965000       1.519600    
 O   0.6422000      -2.774400       1.899800    
 O  -0.2824000      -4.089700      0.2982000    
 N    2.126800       2.165400     -0.4758000    
 N  -0.6618000     -0.6535000     -0.5341000    
 N   -3.809700     -0.3158000       1.113900    
 C    3.328500       1.324400     -0.4493000    
 C    1.526400      5.7700001E-02  -1.314400    
 C    1.100300       1.542200      -1.287500    
 C    3.382100       1.564900       1.068700    
 C   0.7581000     -0.8005000     -0.3131000    
 C    2.057900       2.328200      0.8774000    
 C    1.191100      -2.274200     -0.3724000    
 C   -1.518300     -0.1104000      0.4124000    
 C   -2.970400     -7.6800004E-02 -6.2500000E-02
 C   -3.352400       1.247900     -0.7646000    
 C   0.4412000      -3.153500      0.6118000    
 C   -4.786500       1.214600      -1.301700    
 C   -3.154700       2.493900      0.1058000    
 H    4.157700       1.753100      -1.020300    
 H    1.414100     -0.3315000      -2.332900    
 H   0.1052000       1.743300     -0.8884000    
 H    1.185300       1.977100      -2.288600    
 H   0.9885000     -0.4441000      0.6985000    
 H    3.292400      0.6708000       1.690400    
 H    4.209500       2.188300       1.415800    
 H    2.257700      -2.375100     -0.1425000    
 H   -1.036600     -0.9424000      -1.433000    
 H   -3.134900     -0.9083000     -0.7589000    
 H   -2.684200       1.359200      -1.629700    
 H   7.0600003E-02  -2.693500      -1.916400    
 H   -5.523100       1.172900     -0.4926000    
 H   -4.996000       2.110200      -1.896700    
 H   -4.939200      0.3442000      -1.948400    
 H   -2.119100       2.585200      0.4468000    
 H   -3.807700       2.487900      0.9842000    
 H   -3.385100       3.398800     -0.4676000    
 H   -3.566600      -1.212000       1.534300    
 H   -3.633000      0.3923000       1.824900    
 H   0.1459000      -3.339800       2.529300    


%chk=000059725-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000059725

0 1
O 2.767903 0.087663 -0.558810
O 2.727402 2.923506 2.373894
O 0.476516 -2.316597 -1.944821
O -1.393904 0.494488 1.663698
O 0.853283 -3.145861 1.613165
O -0.131654 -4.279506 -0.165615
N 2.402134 2.318305 0.027716
N -0.916689 -0.623349 -0.317576
N -4.138889 0.321456 1.308199
C 3.441529 1.399846 -0.519924
C 1.317220 0.363354 -0.805733
C 1.038370 1.820140 -0.255897
C 4.310465 1.633790 0.749906
C 0.527046 -0.748472 -0.079089
C 3.071666 2.417461 1.295490
C 0.990601 -2.139396 -0.584960
C -1.791454 -0.035678 0.578157
C -3.288316 -0.034284 0.163356
C -3.513739 0.935795 -1.057620
C 0.497393 -3.292822 0.286657
C -4.958176 0.778331 -1.578349
C -3.221397 2.402124 -0.671125
H 3.846486 1.655780 -1.512728
H 1.127361 0.305754 -1.895630
H 0.438261 1.806541 0.670511
H 0.524560 2.436135 -1.012118
H 0.714174 -0.665716 1.005718
H 4.528995 0.712320 1.310155
H 5.225337 2.231155 0.614709
H 2.098539 -2.147818 -0.583712
H -1.252727 -1.035990 -1.193673
H -3.554031 -1.053763 -0.185311
H -2.810549 0.631588 -1.863689
H 0.175343 -3.261719 -2.038764
H -5.665760 0.996894 -0.759140
H -5.154625 1.476618 -2.412687
H -5.152826 -0.249773 -1.940535
H -2.182474 2.543923 -0.319345
H -3.902840 2.716401 0.139709
H -3.384945 3.071225 -1.535512
H -4.598763 -0.478275 1.750984
H -3.620432 0.884379 1.995410
H 0.535205 -3.919151 2.153026


