%chk=000072729.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072729

0 1
 O   -4.208300      0.6035000      0.2971000    
 O  -0.1693000       1.769700     -0.5956000    
 O    6.000100      0.3230000      0.9822000    
 O    4.333100      0.3133000       2.410400    
 N  -0.6192000      0.6089000     -0.3488000    
 N   -1.599800      -1.931600      0.1911000    
 N  -0.2796000      -1.733100     -7.3299997E-02
 N    4.776800      0.2181000       1.240600    
 C   -3.031600       1.401200     -3.1700000E-02
 C   -3.865600     -0.8090000      0.4348000    
 C   -1.937800      0.3989000     -8.2599998E-02
 C   -2.394100     -0.8602000      0.1796000    
 C   -2.853400       2.428300       1.083500    
 C   -3.296200       2.069000      -1.378900    
 C   -4.218400      -1.249900       1.851800    
 C   -4.656500      -1.595000     -0.6056000    
 C   0.1922000     -0.4894000     -0.3362000    
 C    1.600600     -0.3651000     -0.6062000    
 C    2.501600     -0.1353000      0.4385000    
 C    2.078700     -0.4733000      -1.916100    
 C    3.866300     -1.5200000E-02  0.1761000    
 C    3.443300     -0.3530000      -2.178500    
 C    4.337100     -0.1240000      -1.132400    
 H   -1.991500       3.080100      0.9093000    
 H   -3.746200       3.057200       1.177400    
 H   -2.716900       1.937600       2.054600    
 H   -2.459800       2.699200      -1.697200    
 H   -3.475700       1.322400      -2.161700    
 H   -4.197200       2.691400      -1.332400    
 H   -5.288300      -1.114400       2.046200    
 H   -3.963600      -2.301000       2.025000    
 H   -3.688800     -0.6447000       2.597200    
 H   -5.734100      -1.465400     -0.4545000    
 H   -4.440500      -1.237300      -1.619500    
 H   -4.426100      -2.665100     -0.5672000    
 H    2.114600     -5.3100001E-02   1.452700    
 H    1.395400     -0.6515000      -2.743400    
 H    3.809600     -0.4377000      -3.197500    
 H    5.393200     -3.5799999E-02  -1.374400    


%chk=000072729-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000072729

0 1
O -4.261927 0.622597 0.431895
O -0.055618 1.787349 0.194774
O 5.946560 1.638981 -0.376973
O 4.069971 2.824894 0.141586
N -0.589200 0.591086 -0.014620
N -1.787304 -1.972697 -0.472103
N -0.431948 -1.778294 -0.583184
N 4.668894 1.741358 -0.217578
C -2.990251 1.438963 0.467404
C -4.009879 -0.821485 0.067593
C -1.951898 0.402467 0.102750
C -2.504418 -0.862028 -0.125845
C -2.802436 1.993600 1.895578
C -3.102989 2.566358 -0.580517
C -4.465522 -1.712861 1.239873
C -4.771166 -1.142893 -1.233696
C 0.173839 -0.573134 -0.370770
C 1.648349 -0.529985 -0.524617
C 2.445687 0.624813 -0.293693
C 2.295055 -1.741563 -0.924512
C 3.841359 0.527791 -0.465018
C 3.690656 -1.800127 -1.088426
C 4.489710 -0.659492 -0.859015
H -1.884071 2.601843 1.955032
H -3.672218 2.623821 2.146909
H -2.745344 1.174843 2.633083
H -2.195282 3.193263 -0.573201
H -3.250556 2.151141 -1.592124
H -3.977611 3.191493 -0.333323
H -5.546760 -1.572299 1.407833
H -4.270677 -2.775476 1.010717
H -3.932271 -1.445548 2.168158
H -5.853210 -1.005734 -1.068140
H -4.457135 -0.471206 -2.050790
H -4.582064 -2.187224 -1.538976
H 1.997912 1.570840 0.008478
H 1.671972 -2.622544 -1.097464
H 4.159585 -2.739665 -1.396279
H 5.576303 -0.671547 -0.976400


