%chk=000037547.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037547

0 1
 O    5.989700     -0.6217000      -1.407800    
 N   -2.374700      0.4513000     -0.1976000    
 N   -4.282000       1.270100      0.5974000    
 N  -7.3700003E-02  8.8699996E-02  0.4296000    
 N    6.320400     -6.2899999E-02  0.8195000    
 N    7.696100     -0.1278000      0.7101000    
 C   -3.248400     -0.6055000     -0.1823000    
 C   -3.038200       1.548500      0.2767000    
 C  -0.9985000      0.4079000     -0.6382000    
 C   -4.431600     -6.8800002E-02  0.3180000    
 C   -2.387400       2.869500      0.3967000    
 C   -3.109600      -1.943800     -0.5517000    
 C   -5.553200     -0.9025000      0.4652000    
 C    1.297500     -1.1300000E-02  0.2522000    
 C   -2.537500       3.720500     -0.8692000    
 C   -4.235900      -2.759100     -0.3987000    
 C   -5.436800      -2.249700      0.1006000    
 C    1.879100      0.1983000      -1.011900    
 C    2.143400     -0.3266000       1.331400    
 C    4.080600     -0.2174000     -0.1080000    
 C    3.258700      9.6100003E-02  -1.190500    
 C    3.523000     -0.4287000       1.152900    
 C    5.519100     -0.3252000     -0.2945000    
 H  -0.7561000       1.373200      -1.093500    
 H  -0.9388000     -0.3429000      -1.435000    
 H   -2.851600       3.411900       1.230000    
 H   -1.327600       2.779200      0.6581000    
 H  -0.4412000     -6.9300003E-02   1.361600    
 H   -2.178900      -2.344600     -0.9366000    
 H   -6.490800     -0.5165000      0.8522000    
 H   -2.074700       3.236800      -1.735100    
 H   -2.061100       4.695500     -0.7265000    
 H   -3.594300       3.887600      -1.103900    
 H   -4.174300      -3.809300     -0.6731000    
 H   -6.294900      -2.908100      0.2083000    
 H    1.277100      0.4449000      -1.882300    
 H    1.724000     -0.5010000       2.319900    
 H    3.674100      0.2685000      -2.180100    
 H    4.123400     -0.7032000       2.015400    
 H    5.946700      0.2357000       1.714300    
 H    8.057000      0.7884000      0.9726000    
 H    8.019100     -0.7740000       1.429000    


%chk=000037547-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000037547

0 1
O 6.151651 -0.306007 -1.275667
N -2.370674 0.598422 -0.237464
N -4.406329 1.266274 0.573283
N -0.094500 0.231023 0.432051
N 6.387882 -0.413281 1.028209
N 7.804864 -0.524687 0.969795
C -3.158208 -0.570322 -0.159969
C -3.176061 1.673233 0.223202
C -0.980622 0.648678 -0.663789
C -4.427537 -0.131415 0.343260
C -2.702364 3.099183 0.254875
C -2.887820 -1.917876 -0.470441
C -5.468363 -1.066080 0.538815
C 1.284961 0.096817 0.299257
C -2.865309 3.820094 -1.111964
C -3.942132 -2.836536 -0.271017
C -5.211100 -2.417623 0.225196
C 1.956763 0.419841 -0.919607
C 2.062280 -0.381598 1.398194
C 4.127807 -0.182455 0.075443
C 3.350114 0.274121 -1.018832
C 3.454154 -0.516315 1.284071
C 5.605650 -0.308351 -0.124977
H -0.742434 1.679285 -0.992077
H -0.847116 -0.015215 -1.543698
H -3.310204 3.620043 1.013692
H -1.647892 3.152477 0.587391
H -0.544087 -0.025991 1.311205
H -1.912847 -2.249877 -0.843210
H -6.439799 -0.738358 0.920978
H -2.265610 3.338336 -1.906252
H -2.541189 4.872928 -1.032037
H -3.922281 3.803439 -1.428283
H -3.780088 -3.895301 -0.500981
H -6.000277 -3.164147 0.365558
H 1.395223 0.783179 -1.786238
H 1.560552 -0.657676 2.333813
H 3.872108 0.507420 -1.952949
H 4.005153 -0.924902 2.139502
H 6.008500 -0.240518 1.958496
H 8.185368 0.206027 0.348792
H 8.069011 -1.453588 0.609572


