%chk=000139445.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000139445

0 1
 O    1.281600       2.544900     -0.2564000    
 O    2.118900      -2.150100     -5.1899999E-02
 N   -3.923300     -0.8496000      -1.133400    
 C  -0.9408000     -0.2424000      0.5676000    
 C  -6.4499997E-02  -1.319800      0.4381000    
 C  -0.4884000       1.056300      0.3344000    
 C   0.8402000       1.277600     -2.8300000E-02
 C    1.264200      -1.098700      7.5400002E-02
 C    1.716600      0.2001000     -0.1579000    
 C   -2.361300     -0.4789000      0.9554000    
 C   0.3324000       3.599700     -0.1068000    
 C    3.463400      -1.852400     -0.4255000    
 C   -3.239000     -0.6866000     -0.2106000    
 H  -0.4103000      -2.335000      0.6169000    
 H   -1.212200       1.856800      0.4474000    
 H    2.736600      0.4367000     -0.4425000    
 H   -2.732600      0.3659000       1.549100    
 H   -2.424800      -1.348900       1.621000    
 H  -3.1800002E-02   3.670600      0.9237000    
 H  -0.4841000       3.512600     -0.8317000    
 H   0.8544000       4.537000     -0.3256000    
 H    4.001900      -2.804200     -0.4796000    
 H    3.966600      -1.243500      0.3332000    
 H    3.513600      -1.400200      -1.421900    


%chk=000139445-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000139445

0 1
O 1.193956 2.534706 -0.440583
O 2.280595 -2.160516 0.158738
N -4.164306 1.159594 0.673305
C -0.957635 -0.426662 0.390490
C 0.028857 -1.430835 0.398651
C -0.616415 0.919762 0.113884
C 0.735045 1.241240 -0.155244
C 1.378010 -1.088483 0.125585
C 1.742587 0.245446 -0.153277
C -2.406199 -0.842323 0.687236
C 0.206728 3.619608 -0.450466
C 3.690926 -1.868081 -0.111985
C -3.378249 0.262266 0.680210
H -0.213040 -2.477281 0.610844
H -1.394210 1.687925 0.111593
H 2.770116 0.548270 -0.367771
H -2.456953 -1.337807 1.676616
H -2.737250 -1.594907 -0.055238
H -0.276594 3.731402 0.538994
H -0.566923 3.451953 -1.224141
H 0.781296 4.526437 -0.688901
H 4.204922 -2.836991 -0.031524
H 4.104583 -1.161493 0.633374
H 3.827453 -1.455332 -1.130288


