%chk=000293651.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000293651

0 1
O -1.202829 -0.090344 1.139501
N -1.009538 1.289788 -0.822913
C -0.392340 0.204826 -0.013238
C 0.938187 0.721171 0.639991
C -2.479562 1.270516 -1.078545
C -3.208376 0.939885 0.245450
C -0.185302 -1.101301 -0.834760
C 2.004469 1.024580 -0.429765
C -2.618587 -0.308964 0.906029
C 3.479345 0.834611 0.021207
C 0.644624 1.932853 1.528089
C -2.876161 0.266609 -2.185827
C -2.867608 2.692253 -1.538103
C 0.210084 -2.289223 0.045923
C -3.167283 -0.564613 2.304595
C 4.383047 1.014520 -1.220517
C 3.697807 -0.578934 0.592230
C 3.874421 1.885370 1.073435
C 0.213428 -3.604990 -0.743654
C 0.631032 -4.784610 0.131988
H 1.298748 -0.111786 1.298564
H -0.476694 1.472486 -1.675336
H -4.290774 0.823481 0.075081
H -3.092024 1.799428 0.938507
H 0.590797 -0.926343 -1.605293
H -1.117309 -1.340781 -1.388925
H 1.835132 0.374453 -1.313088
H 1.872183 2.062356 -0.790834
H -2.726107 -1.205922 0.257647
H 0.300455 2.790442 0.938000
H -0.160714 1.696058 2.237740
H 1.533381 2.234425 2.094952
H -3.961165 0.225726 -2.315574
H -2.445779 0.540597 -3.153067
H -2.531433 -0.750648 -1.949890
H -2.519399 3.443003 -0.816613
H -2.420943 2.947366 -2.503512
H -3.951553 2.796193 -1.635357
H 1.209203 -2.112992 0.490669
H -0.486831 -2.357782 0.907184
H -2.943259 0.275779 2.975347
H -4.249915 -0.716544 2.293619
H -2.695997 -1.449816 2.750330
H 4.174664 0.260800 -1.984927
H 5.440769 0.923366 -0.954122
H 4.246842 1.998931 -1.677578
H 4.741135 -0.737776 0.879806
H 3.081819 -0.743480 1.485067
H 3.434427 -1.351185 -0.137112
H 3.196550 1.854107 1.938802
H 4.891446 1.724900 1.441324
H 3.825600 2.899381 0.664803
H 0.897377 -3.523051 -1.610647
H -0.791720 -3.793674 -1.167971
H -0.044723 -4.911455 0.985622
H 1.641710 -4.650402 0.534128
H 0.624544 -5.721844 -0.434959


%chk=000293651-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000293651

0 1
O -1.295780 -0.035372 1.253585
N -0.978411 1.202574 -0.792814
C -0.395561 0.172593 0.097460
C 0.930523 0.747522 0.720414
C -2.416532 1.255643 -1.161849
C -3.237690 0.982283 0.127927
C -0.155779 -1.210074 -0.608362
C 1.943318 1.204847 -0.379882
C -2.718121 -0.244799 0.901918
C 3.461463 0.893973 -0.145472
C 0.614043 1.903533 1.698833
C -2.839755 0.268491 -2.300387
C -2.695839 2.698745 -1.656253
C 0.195005 -2.393113 0.321683
C -3.441663 -0.467452 2.232360
C 4.260180 1.567722 -1.295755
C 3.719365 -0.636278 -0.191423
C 3.969396 1.454985 1.208662
C 0.352189 -3.723043 -0.451583
C 0.704958 -4.913193 0.466558
H 1.376713 -0.085486 1.298127
H -0.346366 1.497178 -1.543460
H -4.303236 0.837687 -0.137466
H -3.163282 1.861844 0.795418
H 0.650554 -1.080883 -1.359197
H -1.059578 -1.475751 -1.187774
H 1.690023 0.744599 -1.358772
H 1.834612 2.300721 -0.515899
H -2.810368 -1.158982 0.273253
H 0.023885 2.678606 1.176870
H 0.020053 1.543552 2.553934
H 1.543149 2.362897 2.077973
H -3.864929 0.497769 -2.648639
H -2.156516 0.364356 -3.165113
H -2.827503 -0.785250 -1.972342
H -2.387428 3.427527 -0.886888
H -2.130156 2.914701 -2.584099
H -3.770046 2.841485 -1.876298
H 1.134784 -2.187775 0.871047
H -0.592856 -2.496185 1.092633
H -3.330750 0.421521 2.878485
H -4.518714 -0.650795 2.064869
H -3.014324 -1.335036 2.764529
H 3.927240 1.195812 -2.284012
H 5.342501 1.357953 -1.202111
H 4.124424 2.666018 -1.282043
H 4.797961 -0.852160 -0.071876
H 3.181405 -1.165299 0.616238
H 3.391979 -1.067000 -1.157417
H 3.453615 0.984151 2.065037
H 5.053288 1.259752 1.319855
H 3.813085 2.548219 1.273589
H 1.139384 -3.606712 -1.225230
H -0.588451 -3.942160 -0.998419
H -0.079788 -5.070341 1.230610
H 1.657523 -4.731934 0.999602
H 0.812103 -5.852388 -0.107130


