%chk=000129151.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000129151

0 1
 O  -4.8099998E-02  -1.341700       1.653000    
 O    1.202800       1.259600      -1.553400    
 N    1.479800     -0.2237000      0.2973000    
 C  -0.9411000      5.1300000E-02 -5.8200002E-02
 C   -1.307400       1.396800      0.5877000    
 C   -2.151000     -0.8960000     -5.9000000E-02
 C   0.1879000     -0.5786000      0.7146000    
 C    2.636600     -0.7038000       1.030200    
 C    3.788700     -0.5275000      6.8800002E-02
 C    3.400000      0.7118000     -0.7159000    
 C    1.891300      0.6368000     -0.7584000    
 C   -2.441900       2.113500     -0.1519000    
 C   -1.850600      -2.229600     -0.7512000    
 C   -2.765300       3.452800      0.4922000    
 C   -3.081600      -3.121700     -0.7958000    
 H  -0.6775000      0.1905000      -1.107300    
 H   -1.596500       1.240000       1.635400    
 H  -0.4245000       2.047800      0.6113000    
 H   -2.501800      -1.082200      0.9642000    
 H   -2.987800     -0.4442000     -0.6009000    
 H    2.503700      -1.742800       1.346800    
 H    2.752100     -7.6800004E-02   1.921700    
 H    3.844900      -1.389100     -0.6082000    
 H    4.753800     -0.4294000      0.5732000    
 H    3.821200      0.7041000      -1.724000    
 H    3.691800       1.628400     -0.1938000    
 H   -2.163900       2.271300      -1.200100    
 H   -3.361700       1.522400     -0.1376000    
 H   -1.507600      -2.045200      -1.776100    
 H   -1.050400      -2.771500     -0.2370000    
 H   -3.576900       3.948500     -4.9600001E-02
 H   -3.080800       3.322400       1.532300    
 H   -1.893900       4.115200      0.4777000    
 H   -3.896600      -2.640400      -1.345600    
 H   -2.847000      -4.066500      -1.296300    
 H   -3.436000      -3.351100      0.2143000    


%chk=000129151-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000129151

0 1
O 0.125959 -1.460559 1.644007
O 1.090763 1.446413 -1.406553
N 1.500056 -0.185827 0.299794
C -1.022001 -0.054407 -0.022058
C -1.373242 1.331522 0.621977
C -2.205958 -1.048103 0.053585
C 0.199971 -0.628202 0.695578
C 2.692108 -0.742540 1.007884
C 3.872857 -0.401204 0.064275
C 3.400140 0.868364 -0.679172
C 1.869149 0.774468 -0.683574
C -2.261557 2.208797 -0.288440
C -2.015110 -2.318037 -0.807341
C -2.642624 3.547311 0.379934
C -3.235734 -3.260762 -0.740887
H -0.753604 0.141800 -1.076518
H -1.875269 1.152170 1.594662
H -0.444551 1.895981 0.835036
H -2.359442 -1.342988 1.109419
H -3.124506 -0.524249 -0.277086
H 2.550236 -1.820551 1.178190
H 2.790085 -0.258395 1.997511
H 4.031543 -1.224849 -0.653826
H 4.810864 -0.251113 0.622702
H 3.773005 0.962911 -1.711432
H 3.683137 1.794351 -0.141698
H -1.710577 2.402485 -1.229300
H -3.183977 1.659966 -0.562402
H -1.828672 -2.024458 -1.861029
H -1.114123 -2.861949 -0.461498
H -3.261314 4.169930 -0.292166
H -3.217212 3.380001 1.310701
H -1.739146 4.129676 0.642219
H -4.150351 -2.753209 -1.102472
H -3.083941 -4.164979 -1.358655
H -3.422263 -3.588366 0.299030


