%chk=000209675.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000209675

2 1
O 5.788614 -0.776159 -0.350930
N -3.521255 -0.177169 0.154413
N 3.189584 0.454447 0.026250
C -2.608983 -1.418685 -0.233405
C -2.853489 1.222290 -0.204020
C -1.258071 -1.271163 0.509697
C -0.673175 0.106429 0.492927
C -1.394672 1.192407 0.194665
C -3.777606 -0.222784 1.655427
C -4.870741 -0.298056 -0.526887
C -2.387063 -1.483664 -1.741641
C -3.294923 -2.713654 0.210511
C 0.777768 0.215167 0.912598
C -2.952690 1.531995 -1.699192
C -3.572650 2.335451 0.567566
C 1.696050 0.301687 -0.312521
C 3.962094 0.509683 -1.300667
C 3.670717 -0.750158 0.839343
C 3.414896 1.733942 0.798520
C 5.483102 0.416338 -1.081370
C 5.206693 -0.785215 0.956181
H -0.545141 -2.005891 0.069021
H -1.361124 -1.609685 1.568538
H -0.949527 2.193944 0.209920
H -4.057652 -1.241846 1.993229
H -2.889490 0.090686 2.229675
H -4.616344 0.435176 1.954040
H -4.768688 -0.452109 -1.617974
H -5.455975 -1.150820 -0.132048
H -5.486784 0.609079 -0.373854
H -1.845075 -2.404179 -2.019223
H -3.324811 -1.529947 -2.318261
H -1.795922 -0.644642 -2.139518
H -2.631170 -3.584017 0.065724
H -3.584979 -2.737728 1.271758
H -4.196120 -2.952177 -0.375350
H 1.051385 -0.649403 1.557075
H 0.903260 1.107528 1.568653
H -2.394383 0.834723 -2.340893
H -3.984005 1.582651 -2.075669
H -2.531746 2.530631 -1.914154
H -3.350805 2.354558 1.642838
H -3.269626 3.331425 0.196686
H -4.665480 2.316938 0.448679
H 1.389202 1.166534 -0.950644
H 1.567825 -0.611540 -0.943263
H 3.708445 1.440528 -1.856872
H 3.646806 -0.350686 -1.941586
H 3.333704 -1.686692 0.330693
H 3.211031 -0.742821 1.852659
H 3.046971 2.620217 0.247878
H 2.915589 1.719851 1.784905
H 4.493487 1.909901 0.994981
H 6.021551 0.254335 -2.044747
H 5.907900 1.304541 -0.579808
H 5.615207 0.034624 1.574091
H 5.558681 -1.758912 1.370057


%chk=000209675-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000209675

2 1
O 5.775844 -1.103316 -0.148960
N -3.556862 -0.221807 0.154227
N 3.235135 0.414271 0.030005
C -2.507985 -1.366000 -0.335102
C -3.015824 1.271962 -0.144144
C -1.200806 -1.154881 0.475684
C -0.700805 0.279865 0.472712
C -1.525557 1.318217 0.174074
C -3.772990 -0.365146 1.667067
C -4.921576 -0.430697 -0.499384
C -2.193738 -1.261985 -1.848686
C -3.088152 -2.776480 -0.067303
C 0.755371 0.524568 0.885624
C -3.312233 1.724112 -1.603340
C -3.733429 2.299501 0.784530
C 1.722799 0.277024 -0.297291
C 4.010520 0.171466 -1.301610
C 3.664097 -0.672534 1.052218
C 3.535476 1.814597 0.560193
C 5.521950 -0.002222 -1.079794
C 5.194661 -0.797473 1.158153
H -0.444967 -1.828855 0.026195
H -1.317655 -1.515988 1.517547
H -1.132623 2.344123 0.201709
H -4.005161 -1.410133 1.904694
H -2.876362 -0.039000 2.209536
H -4.627528 0.254814 1.966973
H -4.826111 -0.497751 -1.589385
H -5.366631 -1.354915 -0.105749
H -5.575547 0.414499 -0.240289
H -1.638637 -2.174181 -2.129543
H -3.093108 -1.246781 -2.484668
H -1.557741 -0.399254 -2.096368
H -2.308052 -3.511264 -0.334069
H -3.348752 -2.975085 0.984278
H -3.958763 -3.004309 -0.703539
H 1.000878 -0.149244 1.728897
H 0.854757 1.561754 1.248962
H -2.964894 1.033966 -2.380545
H -4.386405 1.921679 -1.754823
H -2.790732 2.683925 -1.764312
H -3.457690 2.208867 1.845965
H -3.428301 3.308142 0.456061
H -4.832329 2.261420 0.686583
H 1.522500 0.998405 -1.109549
H 1.597529 -0.742680 -0.702268
H 3.787031 1.020337 -1.971002
H 3.596192 -0.756882 -1.730004
H 3.242426 -1.623382 0.683459
H 3.217600 -0.418915 2.027775
H 3.111108 2.557290 -0.133117
H 3.094602 1.934883 1.560170
H 4.621758 1.960046 0.628170
H 5.986492 -0.295352 -2.034706
H 6.013650 0.930054 -0.732691
H 5.661000 0.108624 1.597654
H 5.434969 -1.653995 1.807829


