%chk=000212670.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212670

0 1
O 0.959343 1.634516 -0.563853
O 1.429294 1.878288 1.626832
N -4.056420 0.361876 -0.852121
C 2.254491 -0.121376 0.418450
C 3.343157 -0.264896 1.512145
C 2.905630 -0.157080 -0.982388
C 4.462305 0.771209 1.357777
C 4.015369 0.891901 -1.126268
C 5.087033 0.727052 -0.041721
C 1.211993 -1.216650 0.627777
C 1.533305 1.226063 0.611980
C 0.328307 -1.122422 1.718562
C 1.130998 -2.332046 -0.215747
C -5.380161 -1.419320 0.231498
C -3.915095 -1.886644 0.159490
C -5.454906 -0.141277 -0.633168
C -3.181432 -0.851158 -0.721819
C -3.706192 1.432650 0.145853
C 0.084540 2.831833 -0.538428
C -0.620129 -2.119183 1.950389
C 0.178615 -3.330082 0.018576
C -0.699458 -3.227341 1.099509
C 0.288982 3.445403 -1.915190
C -2.375143 1.936747 -0.108287
C -1.263476 2.360003 -0.309657
H 3.761342 -1.288610 1.462644
H 2.881549 -0.163284 2.515173
H 2.127331 0.012667 -1.755597
H 3.324712 -1.165672 -1.166340
H 5.238513 0.595740 2.126184
H 4.059228 1.784654 1.562332
H 3.576742 1.908637 -1.075883
H 4.474251 0.810498 -2.129428
H 5.849759 1.521947 -0.139746
H 5.622907 -0.230770 -0.184599
H 0.380346 -0.263848 2.393342
H 1.809347 -2.437633 -1.062098
H -5.679529 -1.213787 1.271936
H -6.069585 -2.192240 -0.143812
H -3.833450 -2.897573 -0.270335
H -3.463254 -1.938834 1.163877
H -5.860025 -0.373276 -1.642377
H -6.115569 0.625120 -0.192960
H -2.176098 -0.606868 -0.328499
H -3.033319 -1.240410 -1.751824
H -3.782592 1.087332 1.206932
H -4.446575 2.263853 0.020074
H 0.435050 3.496610 0.291497
H -1.296789 -2.034307 2.799309
H 0.125704 -4.190507 -0.646606
H -1.437850 -4.004943 1.281516
H -0.378117 4.302361 -2.068894
H 1.323892 3.779632 -2.052751
H 0.075628 2.714043 -2.708858


%chk=000212670-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212670

0 1
O 1.055812 1.544440 -0.759710
O 1.380598 1.909691 1.516382
N -4.359471 0.451417 -0.795186
C 2.414868 -0.086936 0.433903
C 3.384588 -0.140016 1.659150
C 3.246616 -0.171995 -0.878598
C 4.507739 0.920694 1.590655
C 4.344799 0.914833 -0.949695
C 5.298098 0.835087 0.264726
C 1.363642 -1.223529 0.563516
C 1.597219 1.226416 0.488373
C 0.502863 -1.242815 1.694932
C 1.235993 -2.260930 -0.393446
C -5.577290 -1.228743 0.511348
C -4.231733 -1.869211 0.034343
C -5.739265 0.028982 -0.407878
C -3.654852 -0.849455 -1.016073
C -3.717806 1.290392 0.265394
C 0.066584 2.697346 -0.793912
C -0.444568 -2.272653 1.870629
C 0.288157 -3.295997 -0.217765
C -0.554611 -3.310042 0.915241
C 0.141464 3.253722 -2.222137
C -2.391925 1.794638 -0.129111
C -1.266287 2.207498 -0.418344
H 3.827581 -1.155888 1.680338
H 2.810053 -0.012912 2.593098
H 2.579751 -0.097626 -1.755282
H 3.735711 -1.166881 -0.908132
H 5.189406 0.783469 2.452283
H 4.062201 1.928925 1.696290
H 3.872564 1.917627 -0.988258
H 4.912780 0.798050 -1.892850
H 6.051550 1.644811 0.215149
H 5.854071 -0.125023 0.227990
H 0.563995 -0.437621 2.436515
H 1.868246 -2.270700 -1.285823
H -5.515228 -0.928377 1.573298
H -6.432742 -1.919788 0.413411
H -4.392503 -2.858675 -0.429123
H -3.531319 -2.011167 0.875611
H -6.279879 -0.251517 -1.331908
H -6.288967 0.860392 0.066408
H -2.563407 -0.715425 -0.938806
H -3.883304 -1.192695 -2.042155
H -3.606633 0.754722 1.242125
H -4.385834 2.153465 0.452274
H 0.415286 3.437000 -0.047857
H -1.094490 -2.266742 2.753424
H 0.209436 -4.090214 -0.969156
H -1.287058 -4.114081 1.050567
H -0.543065 4.113586 -2.323186
H 1.169698 3.585632 -2.445721
H -0.154636 2.483416 -2.952864


