%chk=000091295.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091295

0 1
 O    4.066800      0.8602000     -0.3330000    
 N   -2.605200     -0.9719000      -1.104500    
 C  -0.8691000       1.123700      1.4800000E-02
 C   -1.977300      0.4099000      0.8464000    
 C   -2.144100      -1.016200      0.2937000    
 C   -1.363100       1.159900      -1.459200    
 C   0.4467000      0.3293000      6.1200000E-02
 C  -0.8563000      -1.839400      0.4733000    
 C   -1.733600     -0.2227000      -2.005200    
 C   0.4289000      -1.071100      0.2577000    
 C  -0.7107000       2.579200      0.5069000    
 C   -1.739400      0.4151000       2.364600    
 C    1.688700      0.9556000     -0.1489000    
 C    1.635300      -1.791500      0.2781000    
 C    2.879100      0.2261000     -0.1317000    
 C    2.853300      -1.145900      8.5699998E-02
 H   -2.927500      0.9445000      0.6946000    
 H   -2.938000      -1.529700      0.8512000    
 H  -0.6029000       1.607200      -2.112800    
 H   -2.248500       1.807200      -1.527600    
 H  -0.8786000      -2.712600     -0.1919000    
 H  -0.8358000      -2.229900       1.499800    
 H   -2.243400     -0.1023000      -2.968200    
 H  -0.8332000     -0.8068000      -2.225300    
 H   -3.529200     -0.5382000      -1.120100    
 H  -0.2058000       2.627800       1.478100    
 H  -0.1308000       3.187700     -0.1961000    
 H   -1.687000       3.067200      0.6103000    
 H  -0.7605000      1.5100000E-02   2.643400    
 H   -1.809300       1.431000       2.766400    
 H   -2.503200     -0.1835000       2.872900    
 H    1.739200       2.024200     -0.3384000    
 H    1.626700      -2.866600      0.4420000    
 H    3.775800      -1.719200      0.1012000    
 H    3.900800       1.808900     -0.4676000    


%chk=000091295-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000091295

0 1
O 4.146478 0.850597 -0.303330
N -2.625497 -1.017636 -1.122330
C -0.884576 1.141797 0.013015
C -1.986646 0.424209 0.866872
C -2.186406 -1.016599 0.305310
C -1.382467 1.168828 -1.478317
C 0.430482 0.336664 0.077436
C -0.892983 -1.847021 0.485591
C -1.724269 -0.242574 -2.017519
C 0.404770 -1.078146 0.250829
C -0.712304 2.607332 0.487797
C -1.709753 0.422370 2.387032
C 1.680841 0.980673 -0.109902
C 1.629320 -1.794424 0.236583
C 2.885573 0.245076 -0.121715
C 2.868832 -1.156372 0.051014
H -2.936551 0.976417 0.690740
H -2.995257 -1.513634 0.876353
H -0.604492 1.637592 -2.114103
H -2.284643 1.814705 -1.528398
H -0.953446 -2.719115 -0.192785
H -0.876589 -2.255164 1.516542
H -2.204889 -0.168564 -3.010360
H -0.793361 -0.821871 -2.155023
H -3.593942 -0.667917 -1.190016
H -0.198956 2.669626 1.463283
H -0.136474 3.206521 -0.242154
H -1.704421 3.086421 0.588552
H -0.709934 0.014235 2.620703
H -1.764546 1.440424 2.811455
H -2.461467 -0.196186 2.914244
H 1.717732 2.069207 -0.244647
H 1.607132 -2.883169 0.371853
H 3.810945 -1.711680 0.036634
H 4.050565 1.829677 -0.409441


