%chk=000213624.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213624

0 1
O 4.749985 -1.796880 0.496259
O 5.338184 1.479788 1.660044
N -0.939406 -1.828136 -0.024311
N 2.684828 -0.951788 0.026358
N -6.706077 -0.649823 -0.776164
C 1.956568 -2.176136 0.457948
C 0.956933 -1.837367 1.580548
C 1.223617 -2.822125 -0.733715
C -0.267108 -1.060699 1.074217
C -0.007852 -2.022847 -1.183742
C -2.199750 -1.145547 -0.467129
C -3.315349 -1.437862 0.557276
C -4.606432 -0.864426 0.101964
C 4.076767 -0.874276 0.060081
C -4.990865 0.526447 0.186834
C -5.659268 -1.552098 -0.483181
C -6.310955 0.633241 -0.369836
C 4.624658 0.404223 -0.477282
C -4.360264 1.685865 0.675257
C -6.993116 1.865762 -0.444241
C -5.032571 2.893460 0.600569
C 5.204595 1.415064 0.300867
C -6.336995 2.980492 0.045112
C 4.587710 0.579045 -1.878378
C 5.714730 2.597020 -0.301765
C 5.089837 1.726030 -2.474679
C 5.654120 2.740870 -1.675825
C 5.060828 0.318317 2.480581
H 2.722465 -2.903395 0.853056
H 0.617162 -2.788959 2.040724
H 1.456253 -1.266105 2.384499
H 1.915993 -2.956106 -1.585607
H 0.903631 -3.841819 -0.432751
H 0.027850 -0.034230 0.767976
H -0.998645 -0.947028 1.905747
H -0.551905 -2.601804 -1.963063
H 0.305223 -1.066608 -1.654224
H -2.505344 -1.554318 -1.455334
H -2.085177 -0.049198 -0.603193
H -3.394912 -2.535474 0.710189
H -3.044166 -1.026001 1.551941
H 2.126112 -0.188060 -0.339380
H -5.743522 -2.599771 -0.708956
H -7.581492 -0.891810 -1.193612
H -3.362955 1.618155 1.103019
H -7.989223 1.927768 -0.867629
H -4.565359 3.802715 0.972221
H -6.822731 3.955012 0.010057
H 4.157798 -0.212566 -2.495687
H 6.151225 3.361116 0.339518
H 5.057323 1.845823 -3.554596
H 6.047747 3.641602 -2.148907
H 3.989832 0.100657 2.472859
H 5.654799 -0.543955 2.144979
H 5.389363 0.663343 3.468887


%chk=000213624-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000213624

0 1
O 4.544854 -1.862094 -0.071703
O 6.672014 0.580283 0.652565
N -0.917984 -1.821467 0.244268
N 2.612498 -0.819666 0.683501
N -6.665637 -0.717690 -1.134264
C 1.931952 -2.088224 1.032166
C 0.804308 -1.822819 2.053321
C 1.340784 -2.781437 -0.223893
C -0.393951 -1.084587 1.418339
C 0.137661 -2.002552 -0.787662
C -2.148758 -1.210362 -0.317233
C -3.399402 -1.435042 0.575189
C -4.656696 -0.874398 -0.043619
C 3.872126 -0.793856 0.107129
C -5.034450 0.528570 -0.132542
C -5.676201 -1.596830 -0.663802
C -6.299005 0.595902 -0.820514
C 4.335141 0.571154 -0.341635
C -4.432981 1.736385 0.313635
C -6.961414 1.818123 -1.071571
C -5.088988 2.958301 0.069227
C 5.648503 1.100021 -0.141645
C -6.339230 2.998944 -0.618025
C 3.431149 1.319998 -1.154208
C 6.020763 2.316793 -0.777654
C 3.799147 2.528859 -1.770654
C 5.114293 3.022713 -1.584669
C 6.428822 -0.450638 1.672560
H 2.701532 -2.750913 1.469442
H 0.448694 -2.797990 2.432460
H 1.190656 -1.244964 2.915020
H 2.128613 -2.886803 -0.990762
H 1.007557 -3.796588 0.064319
H -0.099406 -0.034144 1.133087
H -1.194715 -0.987407 2.172072
H -0.299757 -2.558234 -1.637162
H 0.488478 -1.013372 -1.188827
H -2.341740 -1.680479 -1.299508
H -2.017026 -0.114317 -0.507263
H -3.499066 -2.522466 0.746793
H -3.239678 -0.969324 1.567646
H 2.131756 0.064871 0.858384
H -5.771661 -2.673040 -0.798995
H -7.519069 -0.993720 -1.614013
H -3.474179 1.718688 0.844915
H -7.922872 1.855378 -1.596321
H -4.637446 3.896857 0.409752
H -6.824331 3.965527 -0.794591
H 2.434760 0.902159 -1.343624
H 7.035081 2.686499 -0.599086
H 3.084623 3.066312 -2.402177
H 5.428160 3.957085 -2.062656
H 5.518226 -0.220606 2.259300
H 6.324111 -1.442906 1.206062
H 7.314074 -0.405888 2.325527


