%chk=000086819.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086819

0 1
 O    3.265700      -1.118300      0.3940000    
 N    3.202400       1.180300      0.3925000    
 C   0.3403000      1.0400000E-02 -0.5487000    
 C   -1.286000       1.203100      0.9866000    
 C   -2.129900      9.0800002E-02  -1.111500    
 C   -1.331100      -1.311400      0.8242000    
 C   0.1385000       1.211800      0.4050000    
 C  -0.7030000      0.1026000      -1.687300    
 C   9.3500003E-02  -1.295900      0.2428000    
 C   -2.303000       1.289300     -0.1637000    
 C   -1.508100     -0.1059000       1.762300    
 C   -2.347700      -1.212600     -0.3253000    
 C    1.758400      2.2200000E-02  -1.125400    
 C    2.810100     -6.6500001E-02 -4.5400001E-02
 H   -1.416300       2.058200       1.659400    
 H   -2.858200      0.1566000      -1.927500    
 H   -1.493000      -2.240700       1.381600    
 H   0.3159000       2.156700     -0.1242000    
 H   0.8328000       1.176500       1.251300    
 H  -0.5799000     -0.7370000      -2.383700    
 H  -0.5489000       1.020000      -2.269900    
 H   0.8013000      -1.399500       1.073300    
 H   0.2365000      -2.168300     -0.4078000    
 H   -3.323200       1.303900      0.2390000    
 H   -2.165300       2.227000     -0.7160000    
 H  -0.7992000     -0.1727000       2.596700    
 H   -2.514400     -0.1161000       2.198600    
 H   -3.368800      -1.242400      7.4500002E-02
 H   -2.242300      -2.075700     -0.9939000    
 H    1.924200      0.9245000      -1.727800    
 H    1.908900     -0.8287000      -1.801700    
 H    2.827000       2.041600      8.6000003E-03
 H    3.902700       1.277600       1.120200    


%chk=000086819-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000086819

0 1
O 3.232505 -1.038490 0.580983
N 3.534876 1.224962 0.203784
C 0.327401 0.017087 -0.482413
C -1.375298 1.188309 1.020829
C -2.148512 0.087981 -1.128790
C -1.394344 -1.340548 0.823452
C 0.082041 1.213934 0.484001
C -0.690396 0.119111 -1.660391
C 0.061178 -1.312851 0.284095
C -2.369666 1.287656 -0.168119
C -1.615460 -0.141870 1.785468
C -2.391171 -1.240802 -0.362568
C 1.770633 0.055618 -1.077696
C 2.892791 0.016049 -0.036549
H -1.527530 2.045440 1.706852
H -2.850349 0.160950 -1.983456
H -1.560349 -2.289771 1.370287
H 0.269313 2.170532 -0.049523
H 0.793073 1.165738 1.332438
H -0.526478 -0.720982 -2.366671
H -0.516314 1.059284 -2.225147
H 0.785583 -1.423363 1.111735
H 0.229645 -2.170822 -0.398256
H -3.412274 1.285932 0.208384
H -2.218731 2.243065 -0.711055
H -0.922570 -0.215701 2.647699
H -2.647142 -0.164480 2.191228
H -3.434945 -1.277703 0.009601
H -2.256092 -2.103542 -1.045902
H 1.868189 0.956864 -1.716301
H 1.904000 -0.830374 -1.727157
H 3.262636 2.085705 -0.266419
H 4.283657 1.248484 0.896376


