%chk=000248005.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248005

0 1
O -1.518667 -2.470425 -0.505519
O -0.592512 1.331810 0.614471
N 1.089580 -1.648954 -0.126340
N -0.036816 -0.775588 -0.102721
C 1.000726 -2.710293 0.944458
C 1.256059 -2.263943 -1.497847
C -1.368758 -1.278026 -0.325363
C 0.288012 0.593596 0.235587
C -2.490838 -0.291049 -0.381599
C 1.710708 1.029323 0.052123
C 0.967849 -2.083417 2.335118
C 2.715029 -2.680770 -1.665970
C -3.322385 -0.133806 0.730162
C 2.695180 0.670441 0.974213
C -2.731156 0.409484 -1.570876
C 2.012643 1.856087 -1.038984
C -4.412928 0.749731 0.659332
C 4.007036 1.147314 0.814076
C -3.819225 1.283362 -1.635651
C 3.319132 2.323913 -1.196812
C -4.656145 1.455297 -0.529256
C 4.312416 1.975841 -0.276124
C -5.293378 0.935016 1.851753
C 5.057447 0.768875 1.806786
H 0.127074 -3.387909 0.804491
H 1.918235 -3.331342 0.831072
H 0.570624 -3.124953 -1.662863
H 0.997899 -1.500244 -2.264675
H 1.739791 -1.301787 2.441129
H 0.000123 -1.614237 2.550049
H 1.146856 -2.838789 3.107912
H 3.394703 -1.861806 -1.388567
H 2.974788 -3.543387 -1.042480
H 2.923425 -2.948150 -2.708020
H -3.121982 -0.683184 1.648270
H 2.446352 -0.001043 1.804110
H -2.080906 0.276206 -2.432142
H 1.237761 2.136402 -1.750069
H -4.015257 1.836008 -2.553590
H 3.565040 2.966987 -2.040968
H -5.497284 2.143288 -0.591030
H 5.325447 2.351050 -0.408480
H -5.599032 -0.026816 2.286681
H -4.768049 1.496833 2.639478
H -6.212058 1.489010 1.619877
H 4.836092 1.192389 2.797597
H 5.123869 -0.322054 1.925884
H 6.057382 1.122006 1.523318


%chk=000248005-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248005

0 1
O -1.639859 -2.367462 0.659207
O -0.442535 1.253197 1.669243
N 1.104421 -1.770811 0.668213
N 0.071598 -0.768336 0.607428
C 1.134126 -2.535335 1.963385
C 1.123279 -2.641741 -0.546871
C -1.298632 -1.172136 0.420542
C 0.414090 0.557667 1.055060
C -2.248709 -0.186212 -0.184746
C 1.789879 1.077198 0.764459
C 1.160853 -1.628864 3.202514
C 2.509852 -3.275598 -0.766357
C -3.625226 -0.333699 0.113181
C 2.538564 0.694083 -0.375113
C -1.831386 0.807829 -1.107284
C 2.297279 2.081163 1.630172
C -4.597585 0.515457 -0.465881
C 3.790532 1.289119 -0.664243
C -2.791593 1.647577 -1.704345
C 3.548282 2.670173 1.363052
C -4.161689 1.507523 -1.381936
C 4.289635 2.276562 0.223992
C -6.065491 0.372847 -0.102428
C 4.581940 0.865084 -1.890278
H 0.274118 -3.234872 2.016277
H 2.064507 -3.130864 1.929421
H 0.342107 -3.430482 -0.492095
H 0.874059 -1.996178 -1.409579
H 2.005981 -0.919000 3.160758
H 0.224368 -1.055186 3.311560
H 1.277459 -2.251510 4.107897
H 3.296334 -2.500078 -0.778737
H 2.761538 -4.007827 0.020748
H 2.525758 -3.811528 -1.733073
H -3.924449 -1.127412 0.807315
H 2.140729 -0.071863 -1.048216
H -0.772964 0.914456 -1.367785
H 1.694261 2.389471 2.490354
H -2.476189 2.411159 -2.423739
H 3.945813 3.439440 2.033964
H -4.900191 2.170860 -1.848502
H 5.261050 2.742589 0.018383
H -6.379291 -0.686578 -0.099378
H -6.263585 0.774299 0.909931
H -6.713181 0.919347 -0.809513
H 4.917581 -0.186374 -1.806422
H 3.973195 0.939010 -2.810424
H 5.479268 1.492137 -2.028111


