%chk=000036010.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036010

0 1
 O    4.822900       2.033300      0.4269000    
 N    1.993400     -0.2549000     -0.1879000    
 C  -0.9095000     -0.8155000     -3.3100002E-02
 C   -1.540100       1.539200     -0.7274000    
 C   -3.308100     -0.2540000     -0.6300000    
 C   -2.304500      0.6430000       1.500500    
 C  -0.4491000      0.4558000     -0.7851000    
 C   -2.212200      -1.332600     -0.6881000    
 C   -1.211600     -0.4383000       1.436600    
 C   -2.824500      0.9995000      -1.378100    
 C   -1.826000       1.891900      0.7418000    
 C   -3.585100      0.1077000      0.8386000    
 C   0.1783000      -1.891200     -9.2600003E-02
 C    1.500000      -1.419200      0.5180000    
 C    2.553300      -2.519500      0.4391000    
 C    3.210500      0.2666000      0.4447000    
 C    2.258000     -0.5679000      -1.597000    
 C    3.654300       1.556200     -0.2271000    
 H   -1.205700       2.435000      -1.263700    
 H   -4.224200     -0.6327000      -1.096700    
 H   -2.509500      0.9009000       2.545600    
 H  -0.2272000      0.2476000      -1.836600    
 H   0.3644000      0.9991000     -0.3143000    
 H   -2.560400      -2.239300     -0.1768000    
 H   -2.026700      -1.611700      -1.733300    
 H  -0.3277000     -4.0800001E-02   1.946300    
 H   -1.533900      -1.323300       1.999900    
 H   -3.605200       1.769900      -1.361000    
 H   -2.638200      0.7585000      -2.431900    
 H  -0.9238000       2.297100       1.216500    
 H   -2.590700       2.676700      0.7951000    
 H   -4.379200      0.8622000      0.8949000    
 H   -3.946000     -0.7752000       1.380400    
 H  -0.1658000      -2.756200      0.4939000    
 H   0.2806000      -2.293000      -1.105800    
 H    1.353600      -1.192600       1.579300    
 H    2.162700      -3.414700      0.9416000    
 H    2.794600      -2.843000     -0.5780000    
 H    3.480100      -2.285600      0.9696000    
 H    4.057300     -0.4277000      0.4078000    
 H    3.027400      0.4759000       1.506700    
 H    1.503400      -1.164300      -2.111600    
 H    3.222400      -1.067400      -1.751800    
 H    2.288400      0.3618000      -2.177900    
 H    2.883300       2.329700     -0.1496000    
 H    3.916100       1.431800      -1.281100    
 H    5.517600       1.361700      0.3167000    


%chk=000036010-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000036010

0 1
O 4.667902 2.148271 1.233783
N 2.312144 -0.408145 -0.311605
C -0.907088 -0.711192 -0.161786
C -1.847723 1.520175 -0.998608
C -3.444504 -0.330061 -0.335609
C -2.107559 0.883461 1.442618
C -0.704397 0.480825 -1.148768
C -2.293598 -1.360781 -0.475188
C -0.955136 -0.146177 1.289374
C -3.209130 0.848213 -1.319339
C -1.870046 2.061008 0.457240
C -3.467631 0.208209 1.120653
C 0.182434 -1.812970 -0.320362
C 1.592404 -1.578130 0.284564
C 2.416036 -2.899862 0.241127
C 3.428177 0.104862 0.513778
C 2.678869 -0.553133 -1.734801
C 3.548991 1.642309 0.420614
H -1.672729 2.358984 -1.702109
H -4.410269 -0.822918 -0.566761
H -2.119902 1.266478 2.482851
H -0.688615 0.095432 -2.191014
H 0.278323 0.947916 -0.954042
H -2.468260 -2.210405 0.218173
H -2.280861 -1.779200 -1.503573
H 0.006942 0.348154 1.529648
H -1.090803 -0.979010 2.011642
H -4.031729 1.586987 -1.232039
H -3.212619 0.477043 -2.364590
H -0.908934 2.562546 0.690083
H -2.672460 2.818177 0.569336
H -4.293623 0.937180 1.245918
H -3.655158 -0.624134 1.829302
H -0.201775 -2.733731 0.169097
H 0.274425 -2.070038 -1.397389
H 1.452806 -1.318848 1.352399
H 1.928334 -3.679992 0.854182
H 2.505152 -3.291504 -0.789118
H 3.435951 -2.745702 0.640588
H 4.413263 -0.353310 0.231929
H 3.249771 -0.156277 1.572988
H 1.791287 -0.816372 -2.333429
H 3.465248 -1.325998 -1.917264
H 3.060266 0.408222 -2.122502
H 2.650627 2.116038 0.845886
H 3.650141 1.968736 -0.635893
H 5.512757 1.759161 0.892017


