%chk=000202914.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202914

0 1
O 0.591243 0.423819 0.246409
N 4.169928 0.563508 -0.504455
C -1.703026 0.635431 0.814897
C -2.359309 -1.064416 -1.078457
C -0.679229 0.707140 -0.368373
C -1.022798 -0.355141 -1.442892
C -1.766926 -0.804070 1.291019
C -3.046982 0.938859 0.176483
C -2.135075 -1.723894 0.271978
C -3.397575 0.023200 -0.853925
C -1.507240 -1.249523 2.579372
C -3.893295 1.986792 0.506395
C -2.245555 -3.077876 0.552322
C -4.591905 0.169446 -1.544053
C 1.744643 0.854945 -0.521436
C 2.915692 0.198821 0.227501
C 4.749998 1.838366 0.035278
C 5.170149 -0.553551 -0.441722
C -1.621637 -2.623025 2.859265
C -5.104079 2.129129 -0.195593
C -1.987119 -3.524308 1.860820
C -5.447619 1.233947 -1.206811
C 5.984300 2.239624 -0.789429
C 6.412418 -0.186889 -1.271223
C 7.037708 1.124908 -0.781057
H -1.418437 1.339083 1.620000
H -2.655906 -1.784484 -1.864552
H -0.660167 1.728809 -0.799567
H -0.208864 -1.103808 -1.491494
H -1.098564 0.104926 -2.440442
H -1.214397 -0.554722 3.362319
H -3.634626 2.688220 1.295784
H -2.527152 -3.788572 -0.219971
H -4.871909 -0.525353 -2.331853
H 1.670009 0.498257 -1.561600
H 1.786924 1.955940 -0.504136
H 2.902223 0.507273 1.294397
H 2.760021 -0.902425 0.233716
H 5.021694 1.764403 1.110459
H 3.972592 2.627900 -0.049448
H 4.692313 -1.460169 -0.872961
H 5.470048 -0.803400 0.598479
H -1.421051 -2.980181 3.867403
H -5.775648 2.946874 0.059046
H 6.409020 3.178416 -0.391288
H 5.675369 2.450873 -1.832909
H 6.123627 -0.085142 -2.336806
H 7.147825 -1.009775 -1.222368
H -2.074058 -4.584310 2.090010
H -6.387488 1.353128 -1.742791
H 7.892833 1.403272 -1.423946
H 7.447762 0.994926 0.238108


%chk=000202914-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202914

0 1
O 0.645798 0.180660 0.344517
N 4.293528 0.489795 -0.435378
C -1.710090 0.502254 0.885876
C -2.479074 -1.049547 -1.080784
C -0.640505 0.548705 -0.261239
C -1.075573 -0.415401 -1.417481
C -1.869392 -0.958204 1.299659
C -3.017277 0.956326 0.238905
C -2.301907 -1.798299 0.238323
C -3.436299 0.114858 -0.828310
C -1.624677 -1.496141 2.575799
C -3.779066 2.084715 0.595253
C -2.492787 -3.176044 0.453508
C -4.618769 0.401583 -1.535636
C 1.801009 0.510546 -0.501011
C 3.056149 0.133251 0.300538
C 4.664551 1.918997 -0.269652
C 5.436851 -0.403108 -0.115652
C -1.824064 -2.881583 2.797604
C -4.972329 2.372760 -0.114231
C -2.256634 -3.717991 1.741886
C -5.389971 1.535296 -1.174436
C 5.845106 2.298372 -1.186720
C 6.643375 -0.101283 -1.028056
C 7.060530 1.383006 -0.914271
H -1.391340 1.149963 1.718911
H -2.819066 -1.709009 -1.897765
H -0.572875 1.592806 -0.637315
H -0.328522 -1.225238 -1.506077
H -1.131370 0.119070 -2.382204
H -1.276346 -0.849176 3.388971
H -3.455552 2.733192 1.418038
H -2.823555 -3.824065 -0.367019
H -4.943846 -0.247641 -2.357302
H 1.781361 -0.058628 -1.453387
H 1.789238 1.595991 -0.746290
H 2.999966 0.616901 1.305636
H 3.038683 -0.958750 0.469484
H 4.944405 2.135208 0.796911
H 3.785818 2.546404 -0.507163
H 5.109212 -1.450113 -0.255210
H 5.754052 -0.292286 0.956163
H -1.641097 -3.307805 3.790584
H -5.574973 3.245558 0.161467
H 6.111482 3.360685 -1.023724
H 5.526501 2.188653 -2.241401
H 6.360595 -0.326388 -2.074744
H 7.485850 -0.766333 -0.756162
H -2.409951 -4.788291 1.921402
H -6.314982 1.762281 -1.716587
H 7.884383 1.609950 -1.617188
H 7.444149 1.578734 0.108864


