%chk=000211481.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211481

0 1
O -6.368914 -0.647027 -0.445515
N 1.262643 -0.025586 1.275404
C -1.884610 1.133541 -0.715450
C -0.577128 1.280359 0.100527
C -0.055029 -0.089535 0.577618
C -2.867955 0.180638 -0.031413
C -1.074061 -0.699658 1.561138
C -2.471744 -0.687551 1.010638
C -2.514651 2.533739 -0.855458
C -1.567475 0.563983 -2.112512
C -4.190003 0.145678 -0.482525
C -3.407472 -1.561601 1.581451
C 2.405765 0.245483 0.352378
C -5.107368 -0.740099 0.110256
C -4.734281 -1.602353 1.145462
C 3.717619 0.200722 1.158261
C 4.899518 0.368009 0.244351
C 5.463446 -0.749591 -0.390874
C 5.441964 1.641518 0.013543
C -7.399676 -1.516276 0.078507
C 6.559079 -0.592945 -1.243320
C 6.538263 1.792482 -0.839970
C 7.099308 0.677242 -1.469801
H -0.757009 1.937123 0.972167
H 0.185015 1.794247 -0.511644
H 0.053197 -0.774099 -0.304421
H -1.060563 -0.148875 2.525166
H -0.756227 -1.733661 1.811531
H -1.797029 3.257231 -1.254371
H -3.375224 2.526018 -1.533940
H -2.869615 2.909437 0.110575
H -1.110202 -0.429766 -2.043230
H -2.474404 0.458336 -2.718385
H -0.878518 1.211479 -2.662827
H 1.240771 0.674435 2.023619
H -4.532951 0.791962 -1.288489
H -3.098819 -2.229656 2.386206
H 2.420327 -0.547564 -0.428789
H 2.321600 1.217261 -0.180714
H -5.437361 -2.286850 1.604064
H 3.778686 -0.762622 1.709707
H 3.715525 0.979925 1.945826
H 5.046303 -1.740032 -0.218524
H 5.010563 2.513671 0.499512
H -7.131994 -2.564320 -0.082914
H -8.265773 -1.233156 -0.533386
H -7.579117 -1.299454 1.135309
H 6.993717 -1.463228 -1.732320
H 6.956534 2.782385 -1.014147
H 7.952927 0.796700 -2.132874


%chk=000211481-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211481

0 1
O -6.495110 -0.670344 -0.432465
N 1.273180 -0.035614 1.227548
C -1.913005 1.116965 -0.783649
C -0.582840 1.242543 0.019514
C -0.056445 -0.106703 0.574647
C -2.909673 0.187883 -0.050769
C -1.085536 -0.650913 1.581913
C -2.508873 -0.649743 1.035884
C -2.503273 2.546160 -0.953629
C -1.618279 0.528675 -2.198336
C -4.250480 0.128518 -0.496390
C -3.470616 -1.500540 1.629884
C 2.431400 0.257657 0.360675
C -5.197904 -0.723095 0.113421
C -4.811386 -1.551951 1.193740
C 3.758025 0.039697 1.136421
C 4.979269 0.302521 0.269247
C 5.587773 -0.749796 -0.463016
C 5.511448 1.611437 0.135512
C -7.511851 -1.531890 0.171338
C 6.695786 -0.503682 -1.305157
C 6.619036 1.863820 -0.705314
C 7.215567 0.805790 -1.429942
H -0.739359 1.926644 0.881307
H 0.177320 1.712507 -0.634974
H 0.040486 -0.826246 -0.263167
H -1.037977 -0.018584 2.496755
H -0.790368 -1.668935 1.895799
H -1.747752 3.213555 -1.410283
H -3.392809 2.554637 -1.608399
H -2.795887 2.971359 0.023647
H -1.161181 -0.475251 -2.135713
H -2.548379 0.432377 -2.787043
H -0.926566 1.191615 -2.752445
H 1.249666 0.576307 2.057236
H -4.595887 0.746181 -1.331545
H -3.159968 -2.147080 2.460474
H 2.397249 -0.437488 -0.501238
H 2.435451 1.290900 -0.065187
H -5.520045 -2.225701 1.684402
H 3.756997 -0.996612 1.520511
H 3.764939 0.712581 2.018072
H 5.192154 -1.768787 -0.366283
H 5.058865 2.436114 0.701038
H -7.242784 -2.602719 0.079094
H -8.432951 -1.332194 -0.396133
H -7.671005 -1.283039 1.239201
H 7.155674 -1.330601 -1.858549
H 7.018892 2.880746 -0.792358
H 8.076608 0.998417 -2.079890


