%chk=000127598.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127598

0 1
 N    2.514300      -1.894700      0.2213000    
 N   0.1594000      -1.525800      0.2860000    
 N   0.9899000      -3.662900      0.3005000    
 C    1.873900       1.769900      0.2426000    
 C    1.544100      0.3760000      0.7703000    
 C    2.706700     -0.4401000      0.1929000    
 C    2.324200       1.528200      -1.205600    
 C   0.7050000       2.721300      0.4390000    
 C    2.884200      9.6400000E-02  -1.230600    
 C   0.1957000     -0.1475000      0.3096000    
 C  -0.6316000       2.201700     -0.1227000    
 C  -0.7995000      0.6837000     -7.7799998E-02
 C   -2.116900      0.1774000     -0.6177000    
 C   -1.780200       2.941400      0.5773000    
 C    1.287300      -2.322800      0.2729000    
 C   -3.112600     -7.2999999E-02  0.5055000    
 C   -4.448900     -0.5569000     -5.8400001E-02
 C   -4.295000      -1.872400     -0.8051000    
 H    2.735300       2.166800      0.7986000    
 H    1.567400      0.3508000       1.867500    
 H    3.612500     -0.2135000      0.7709000    
 H    3.085000       2.257300      -1.504500    
 H    1.498300       1.615100      -1.919700    
 H   0.9366000       3.695800     -8.9999996E-03
 H   0.5984000       2.899700       1.518200    
 H    2.338500     -0.5062000      -1.966200    
 H    3.939100      8.5100003E-02  -1.524900    
 H  -0.6614000       2.485800      -1.184200    
 H  -0.7475000      -1.957100      0.1434000    
 H   -2.526300      0.8885000      -1.346000    
 H   -1.932600     -0.7361000      -1.193500    
 H   -1.884000       2.625900       1.621100    
 H   -1.595500       4.022000      0.5753000    
 H   -2.735600       2.790700      6.5700002E-02
 H   -2.719800     -0.8228000       1.203700    
 H   -3.299200      0.8284000       1.095300    
 H   -5.149400     -0.6989000      0.7727000    
 H   -4.884400      0.1996000     -0.7210000    
 H    1.723700      -4.362900      0.2882000    
 H   3.1599998E-02  -3.992400      0.3410000    
 H   -5.283700      -2.287800      -1.027500    
 H   -3.748700      -2.610600     -0.2095000    
 H   -3.782700      -1.742800      -1.762700    


%chk=000127598-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127598

0 1
N 2.397200 -1.975960 0.182275
N 0.029110 -1.447907 0.284901
N 0.771106 -3.685532 0.208736
C 1.944297 1.795783 0.319770
C 1.585237 0.374669 0.803558
C 2.658923 -0.522460 0.113454
C 2.404601 1.596765 -1.167154
C 0.780804 2.778617 0.552915
C 2.740253 0.075837 -1.328845
C 0.199836 -0.034881 0.326929
C -0.556206 2.344765 -0.106800
C -0.782831 0.831671 -0.079605
C -2.105723 0.305122 -0.632168
C -1.722554 3.148207 0.530921
C 1.134161 -2.328767 0.234862
C -3.135549 -0.126614 0.455442
C -4.421412 -0.769722 -0.121778
C -4.200054 -2.175206 -0.727703
H 2.815598 2.142847 0.911851
H 1.648777 0.275995 1.905525
H 3.627784 -0.349888 0.620885
H 3.277555 2.235891 -1.391919
H 1.600201 1.891521 -1.865316
H 1.048192 3.792022 0.191977
H 0.616991 2.866709 1.647195
H 1.990530 -0.424062 -1.968719
H 3.729969 -0.099945 -1.784469
H -0.522043 2.638716 -1.182419
H -0.882205 -1.818886 0.013426
H -2.579518 1.082608 -1.263588
H -1.916972 -0.550844 -1.314785
H -1.829794 2.893233 1.601978
H -1.523465 4.234374 0.456787
H -2.688768 2.951766 0.032090
H -2.658353 -0.834563 1.164898
H -3.403663 0.764214 1.055330
H -5.179946 -0.842939 0.682875
H -4.849955 -0.097866 -0.893463
H 1.556186 -4.331101 0.136035
H -0.045986 -3.997970 0.732030
H -5.147168 -2.602990 -1.104348
H -3.799465 -2.872172 0.034199
H -3.490083 -2.150757 -1.574863


