%chk=000001971.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001971

0 1
 O   -5.483700      -1.964600     -0.2683000    
 N    3.599500      0.4698000      0.1334000    
 N  -0.8811000       1.560600     -4.1999999E-03
 N    1.207400       2.335200     -7.8599997E-02
 N    1.960500      -1.265000      0.3111000    
 N  -0.4371000     -0.8137000      0.2520000    
 N   0.3868000      -2.990700      0.4909000    
 C    4.744800     -0.4334000      0.2356000    
 C    6.087000     -6.0800001E-02 -0.3249000    
 C    5.282600      -1.152300     -0.9678000    
 C   -2.345400       1.567800     -1.2400000E-02
 C   -2.985400      0.7232000      -1.130700    
 C   -3.591400     -0.5170000     -0.4473000    
 C   -2.941900      0.9966000       1.235800    
 C   -3.630200     -0.1239000      0.9975000    
 C    2.258600      4.9300000E-02  0.1719000    
 C  -6.9399998E-02  0.4693000      0.1162000    
 C    1.221500      0.9709000      6.8300001E-02
 C   -4.964900     -0.8686000      -1.001600    
 C  -6.8800002E-02   2.657000     -0.1191000    
 C   0.6505000      -1.609700      0.3420000    
 H    4.755100     -0.9701000       1.179200    
 H    6.966700     -0.3470000      0.2383000    
 H    6.180600      0.8764000     -0.8595000    
 H    4.837400     -0.9468000      -1.933400    
 H    5.619200      -2.173200     -0.8360000    
 H   -2.653500       2.614400     -0.1253000    
 H   -2.275800      0.4373000      -1.915800    
 H   -3.771300       1.315300      -1.618700    
 H   -2.930000      -1.385600     -0.5489000    
 H    3.748700       1.468700      3.4600001E-02
 H   -2.824000       1.437300       2.215700    
 H   -4.115600     -0.7026000       1.770900    
 H   -4.893600      -1.152300      -2.056700    
 H   -5.664900     -3.0700000E-02 -0.9095000    
 H  -0.4587000       3.659800     -0.2292000    
 H   -6.355800      -2.173500     -0.6441000    
 H  -0.5708000      -3.312400      0.5211000    
 H    1.158900      -3.638700      0.5639000    


%chk=000001971-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001971

0 1
O -5.565522 -1.990638 0.014533
N 3.622973 0.386089 0.162588
N -0.888848 1.559307 -0.115115
N 1.275645 2.340035 -0.040390
N 2.006106 -1.354798 0.164582
N -0.424360 -0.890584 0.013426
N 0.423988 -3.070916 0.160849
C 4.742725 -0.515256 0.290807
C 6.128816 0.005540 -0.085587
C 5.446828 -1.060773 -0.962720
C -2.376637 1.621186 -0.137192
C -3.034679 0.638003 -1.162400
C -3.695491 -0.499730 -0.324340
C -3.001501 1.214430 1.195154
C -3.721822 0.070427 1.084084
C 2.313053 -0.025471 0.114223
C -0.068333 0.426086 -0.017332
C 1.258202 0.934007 0.023733
C -5.075634 -0.906554 -0.855973
C -0.024202 2.672584 -0.120793
C 0.672172 -1.713961 0.110685
H 4.665022 -1.203743 1.138701
H 6.975348 -0.287599 0.540969
H 6.201286 1.019284 -0.494148
H 5.051114 -0.741862 -1.930634
H 5.820408 -2.087756 -0.931297
H -2.605283 2.674353 -0.390994
H -2.292985 0.251353 -1.879396
H -3.806954 1.188434 -1.733516
H -3.044779 -1.396257 -0.326021
H 3.777382 1.396363 0.174698
H -2.828750 1.786658 2.111971
H -4.244417 -0.442309 1.896954
H -4.983599 -1.256401 -1.907417
H -5.767095 -0.035600 -0.828155
H -0.406474 3.689491 -0.187145
H -6.444335 -2.306728 -0.312892
H -0.536505 -3.400733 0.156016
H 1.209639 -3.709663 0.235888


