%chk=000146813.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000146813

0 1
 O    3.611300       2.129200      -1.789300    
 O    5.132300      -1.121200       1.092300    
 O   -3.584700       2.146700       1.781100    
 O   -5.150900      -1.121900      -1.055400    
 N    1.847400     -0.3000000      7.8100003E-02
 N   -1.851100     -0.3011000     -9.0300001E-02
 N    4.373900      0.4817000     -0.3747000    
 N   -4.369700      0.4903000      0.3892000    
 C   0.5010000     -0.4946000      0.5762000    
 C  -0.5019000     -0.5007000     -0.5961000    
 C   0.1992000      -1.998600      0.7419000    
 C  -0.1959000      -2.005200     -0.7498000    
 C    2.000200       1.089200     -0.3543000    
 C    2.794200     -0.6053000       1.150400    
 C   -1.994900       1.091700      0.3334000    
 C   -2.812500     -0.6123000      -1.147900    
 C    3.383800       1.278900     -0.9290000    
 C    4.201700     -0.4684000      0.6206000    
 C   -3.370500       1.289200      0.9244000    
 C   -4.212700     -0.4678000     -0.6009000    
 H   0.2696000      8.8600002E-02   1.473200    
 H  -0.2739000      7.8900002E-02  -1.496300    
 H  -0.6385000      -2.207500       1.420700    
 H   0.9980000      -2.697000       1.000700    
 H   0.6419000      -2.217700      -1.427300    
 H  -0.9957000      -2.704100      -1.004400    
 H    1.866600       1.800300      0.4708000    
 H    1.301100       1.359200      -1.150900    
 H    2.703700      -1.635500       1.506600    
 H    2.682500      6.4999998E-02   2.012000    
 H   -1.871100       1.795500     -0.4994000    
 H   -1.286100       1.369100       1.118600    
 H   -2.725700      -1.645900      -1.495000    
 H   -2.709000      5.0200000E-02  -2.016400    
 H    5.316600      0.6049000     -0.7334000    
 H   -5.307300      0.6186000      0.7592000    


%chk=000146813-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000146813

0 1
O 3.073974 2.790618 -1.219556
O 5.369709 -0.566878 1.021475
O -3.070600 2.802935 1.198585
O -5.372165 -0.565035 -1.020634
N 1.827168 -0.316203 0.199349
N -1.828974 -0.314683 -0.201421
N 4.189386 1.058042 -0.146199
N -4.189011 1.065464 0.136348
C 0.569036 -1.011592 0.544082
C -0.571833 -1.013546 -0.542845
C 0.661558 -2.572166 0.416769
C -0.666381 -2.573326 -0.407852
C 1.711077 1.135495 -0.023058
C 2.918129 -0.638490 1.142060
C -1.710586 1.138161 0.012310
C -2.920759 -0.640896 -1.141857
C 3.018910 1.740434 -0.531653
C 4.261997 -0.082557 0.679433
C -3.017373 1.748383 0.517249
C -4.263616 -0.080177 -0.682088
H 0.157044 -0.699317 1.534887
H -0.159664 -0.706708 -1.535273
H 0.657662 -3.149681 1.353921
H 1.531819 -2.862436 -0.195043
H -0.663313 -3.155390 -1.342186
H -1.536959 -2.859532 0.205414
H 1.419252 1.708107 0.897931
H 0.950792 1.342546 -0.792021
H 3.031829 -1.730427 1.230146
H 2.731685 -0.245653 2.176707
H -1.417720 1.704717 -0.912094
H -0.950002 1.348655 0.780067
H -3.036173 -1.733149 -1.223426
H -2.734069 -0.254517 -2.178895
H 5.081831 1.450199 -0.472538
H -5.080757 1.461006 0.460507


