%chk=000077003.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077003

0 1
 O  -0.9781000       1.946300     -0.3551000    
 O    5.713900      0.4587000      0.3896000    
 O    5.280800      -1.599100     -0.2407000    
 N   -1.496000     -0.2995000      8.5199997E-02
 N    4.903700     -0.4394000      5.5199999E-02
 C   0.7948000      0.4664000     -7.6499999E-02
 C   -2.912400     -0.3035000      7.4800000E-02
 C  -0.6247000      0.7793000     -0.1213000    
 C    1.713900       1.448500      0.2925000    
 C    1.237100     -0.8159000     -0.4019000    
 C    3.517800     -0.1339000      1.0700000E-02
 C    3.075500       1.148300      0.3359000    
 C    2.598500      -1.116100     -0.3584000    
 C   -3.590100      0.8798000     -0.1647000    
 C   -3.587100      -1.490500      0.3037000    
 C   -4.984900      0.8759000     -0.1754000    
 C   -4.981900      -1.494200      0.2929000    
 C   -5.680800     -0.3110000      5.3399999E-02
 H    1.389500       2.452200      0.5549000    
 H   0.5642000      -1.601700     -0.7320000    
 H   -1.093000      -1.204900      0.3106000    
 H    3.762600       1.938000      0.6289000    
 H    2.908200      -2.123100     -0.6264000    
 H   -3.125800       1.836600     -0.3499000    
 H   -3.052900      -2.417800      0.4909000    
 H   -5.530500       1.796600     -0.3618000    
 H   -5.524100      -2.418300      0.4709000    
 H   -6.766900     -0.3140000      4.5000002E-02


%chk=000077003-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000077003

0 1
O -0.987937 2.007987 -0.237783
O 5.830985 0.507484 0.392858
O 5.409217 -1.635271 -0.267362
N -1.532904 -0.256734 0.087998
N 5.029000 -0.441868 0.046247
C 0.822855 0.410031 -0.052801
C -2.958333 -0.226591 0.066983
C -0.638678 0.797289 -0.082978
C 1.750090 1.423744 0.304292
C 1.301887 -0.880619 -0.405855
C 3.573427 -0.143665 0.007797
C 3.129399 1.154399 0.344071
C 2.680242 -1.166085 -0.376993
C -3.707581 0.952385 -0.193219
C -3.633297 -1.452836 0.316641
C -5.117471 0.882166 -0.202981
C -5.040831 -1.504061 0.304687
C -5.793249 -0.334713 0.043304
H 1.361212 2.419443 0.537266
H 0.614871 -1.662098 -0.750324
H -1.125622 -1.169271 0.305110
H 3.859637 1.917671 0.624469
H 3.073630 -2.147998 -0.651868
H -3.185129 1.892596 -0.375532
H -3.056463 -2.365096 0.519534
H -5.691270 1.793440 -0.404545
H -5.548897 -2.454850 0.498619
H -6.887489 -0.373179 0.033366


