%chk=000182177.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000182177

0 1
O 0.251682 2.393429 -1.027565
N -0.543883 -0.331463 -0.340688
C 0.811382 -0.416164 0.306977
C 1.756269 0.549441 -0.487625
C 1.366732 -1.867188 0.213190
C 0.716136 0.022036 1.788016
C 1.413036 2.051328 -0.269574
C -1.526881 -1.325371 0.191503
C 0.371577 -2.907094 0.740141
C 0.274257 1.481406 1.933108
C 1.228092 2.432068 1.206131
C -1.000145 -2.775112 0.069430
C -2.865041 -1.177873 -0.561886
C 3.195544 0.332948 -0.116371
C -3.538086 0.170820 -0.269521
C 4.154124 0.078574 -1.020061
C -4.854691 0.280709 -0.982885
C 5.509786 -0.109714 -0.663343
C -5.985819 0.495092 -0.367611
C 6.669613 -0.272774 -0.372747
C -7.114369 0.713616 0.238569
H 1.609904 0.353964 -1.582276
H 2.318829 -1.949049 0.769554
H 1.622626 -2.097416 -0.838268
H 1.698520 -0.125760 2.274799
H 0.008969 -0.634567 2.330996
H -0.448039 -0.456762 -1.357627
H 2.193343 2.690406 -0.748895
H -1.686440 -1.087125 1.276158
H 0.265377 -2.806355 1.838049
H 0.774773 -3.924215 0.570055
H 0.213878 1.752552 3.003663
H -0.752033 1.599505 1.527189
H -0.930706 -3.069991 -0.993972
H -1.716454 -3.479125 0.530156
H 0.837907 3.468384 1.258672
H 2.212080 2.449068 1.710604
H -3.544968 -2.000702 -0.265297
H -2.713872 -1.295624 -1.651755
H 3.419677 0.411564 0.949901
H -0.538390 1.897167 -0.692988
H -2.876126 1.003003 -0.594477
H -3.663626 0.302950 0.824104
H 3.944602 0.003922 -2.093741
H -4.816155 0.176963 -2.069576
H 7.662444 -0.411478 -0.126905
H -7.760488 -0.078124 0.595721
H -7.500845 1.706133 0.433766


%chk=000182177-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000182177

0 1
O -0.023387 2.171057 -0.922979
N -0.521724 -0.380499 -0.298240
C 0.855360 -0.481328 0.344065
C 1.777700 0.509123 -0.467432
C 1.367820 -1.946596 0.227195
C 0.785505 -0.031904 1.833556
C 1.284835 1.996578 -0.286428
C -1.548248 -1.333481 0.242582
C 0.349385 -2.976229 0.776343
C 0.342704 1.437159 2.019993
C 1.230571 2.404333 1.204716
C -1.049520 -2.799485 0.137140
C -2.889368 -1.122766 -0.495533
C 3.239547 0.374028 -0.119136
C -3.551802 0.247954 -0.200129
C 4.223341 0.153733 -1.043805
C -4.823706 0.458896 -1.010622
C 5.620485 0.065117 -0.745016
C -6.042116 0.624385 -0.499074
C 6.837542 -0.023967 -0.538196
C -7.255670 0.797261 0.019803
H 1.655790 0.270962 -1.546608
H 2.336569 -2.051767 0.751538
H 1.567938 -2.162162 -0.844334
H 1.793680 -0.171219 2.272053
H 0.116326 -0.700098 2.405968
H -0.407586 -0.590219 -1.308704
H 1.973117 2.664390 -0.835391
H -1.698064 -1.080190 1.310666
H 0.266984 -2.875203 1.876567
H 0.722542 -4.000495 0.586082
H 0.381198 1.700224 3.094232
H -0.711075 1.553125 1.701302
H -1.006957 -3.080634 -0.937059
H -1.779455 -3.480011 0.617569
H 0.831001 3.433066 1.262280
H 2.256584 2.426533 1.625768
H -3.585974 -1.932097 -0.202233
H -2.726927 -1.233837 -1.589172
H 3.534017 0.498225 0.932357
H -0.560282 1.351934 -0.632732
H -2.831745 1.055151 -0.439487
H -3.779685 0.325328 0.879096
H 3.941850 0.036276 -2.101339
H -4.705874 0.468309 -2.106167
H 7.892662 -0.095980 -0.348419
H -7.922157 -0.051586 0.220327
H -7.639630 1.796610 0.261837


