%chk=000206420.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206420

0 1
O 1.355289 0.153942 -1.700254
N -3.400354 -0.836077 0.239644
C 3.327971 -0.051440 -0.484597
C 1.785265 -0.231302 -0.370424
C 1.136772 0.673419 0.691633
C 3.748337 1.347587 0.015303
C 1.399409 2.178385 0.468795
C 2.695706 2.402077 -0.336799
C 4.173954 -1.170687 0.175575
C 1.326218 -1.708521 -0.175764
C 0.213490 2.856541 -0.229422
C 5.661758 -0.992343 -0.163209
C 3.981443 -1.249228 1.694970
C -0.103810 -1.852715 -0.206643
C -3.106407 0.317009 -0.674637
C -4.880386 -1.058460 0.368113
C -2.744204 -2.099851 -0.255333
C -3.751284 1.599082 -0.122515
C -5.547752 0.204676 0.937475
C -5.264708 1.425177 0.053219
C -1.305203 -1.965730 -0.238410
H 3.540698 -0.088604 -1.590158
H 1.526782 0.379625 1.685220
H 0.046392 0.484576 0.744846
H 4.719522 1.620919 -0.437423
H 3.915601 1.328982 1.110219
H 1.523563 2.648698 1.475748
H 3.086054 3.417389 -0.154635
H 2.473151 2.342158 -1.423660
H 3.854737 -2.148524 -0.268969
H 1.723376 -2.100748 0.792113
H 1.783728 -2.330754 -0.980405
H 0.048077 2.435868 -1.228301
H -0.712660 2.735881 0.342028
H 0.387672 3.930531 -0.353124
H 6.245810 -1.858733 0.165426
H 6.089840 -0.110267 0.324869
H 5.818912 -0.880510 -1.241372
H 4.182148 -0.283683 2.175658
H 2.953791 -1.538076 1.952623
H 4.654556 -1.985994 2.145228
H 0.383030 0.210318 -1.749419
H -3.447677 0.137529 -1.716407
H -2.001944 0.446129 -0.710133
H -5.036405 -1.905522 1.071053
H -5.360181 -1.337461 -0.594484
H -3.533037 2.445604 -0.797923
H -3.290463 1.848108 0.854906
H -5.164040 0.390755 1.961221
H -6.635532 0.038702 1.034919
H -3.084670 -2.401370 -1.276813
H -3.040522 -2.926611 0.440616
H -5.703378 2.333660 0.505325
H -5.752636 1.305087 -0.932213


%chk=000206420-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206420

0 1
O 1.332500 0.142651 -1.693737
N -3.550942 -0.849077 0.140055
C 3.394117 -0.104838 -0.455715
C 1.831651 -0.232349 -0.335478
C 1.251110 0.742944 0.718049
C 3.860796 1.345373 -0.115802
C 1.529701 2.248761 0.400495
C 2.800901 2.405575 -0.482258
C 4.242108 -1.189479 0.295013
C 1.346640 -1.701491 -0.077616
C 0.312265 2.949362 -0.246192
C 5.718833 -1.134923 -0.174957
C 4.188655 -1.127020 1.843892
C -0.117206 -1.830981 -0.197671
C -3.254233 0.415451 -0.580818
C -5.010658 -1.124205 0.183842
C -2.812287 -2.010158 -0.429028
C -3.955048 1.611103 0.094083
C -5.764174 0.024463 0.883955
C -5.479948 1.373446 0.183997
C -1.346192 -1.890060 -0.311134
H 3.578655 -0.269230 -1.537508
H 1.693843 0.483512 1.699814
H 0.160676 0.573358 0.815645
H 4.808277 1.553622 -0.647064
H 4.082372 1.430042 0.967406
H 1.730371 2.750561 1.370872
H 3.216512 3.424832 -0.355797
H 2.519783 2.287769 -1.544665
H 3.853121 -2.182269 -0.010415
H 1.668386 -2.048642 0.921941
H 1.826801 -2.360230 -0.827541
H 0.063579 2.467178 -1.209498
H -0.579139 2.904261 0.409380
H 0.530591 4.015689 -0.448044
H 6.298220 -1.972291 0.257609
H 6.207428 -0.194623 0.140236
H 5.792497 -1.202945 -1.276839
H 4.657957 -0.203254 2.229072
H 3.157715 -1.168702 2.238720
H 4.745300 -1.980385 2.274718
H 0.354838 -0.045837 -1.705950
H -3.583448 0.349739 -1.653450
H -2.159216 0.565907 -0.578585
H -5.170485 -2.072382 0.732002
H -5.429256 -1.260322 -0.850485
H -3.733873 2.533977 -0.475890
H -3.539138 1.736878 1.112464
H -5.429140 0.076878 1.937708
H -6.849136 -0.195872 0.885580
H -3.075758 -2.177841 -1.507750
H -3.138468 -2.916405 0.118881
H -5.971758 2.202793 0.726603
H -5.910897 1.354889 -0.838848


