%chk=000235054.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000235054

0 1
O -1.747734 -0.977388 -2.312442
N 1.532296 0.157373 -1.182355
N -2.411886 -0.453983 0.546700
C 0.546111 -0.706091 -1.902022
C -0.856541 -0.368138 -1.352833
C 1.729685 1.460962 -1.900258
C 2.838581 -0.542032 -0.955788
C -1.097832 -0.966845 0.047344
C 2.313120 2.521080 -0.949431
C 2.694589 -1.672368 0.078355
C 1.338332 2.881878 0.179593
C 2.218594 -1.155613 1.442101
C -3.127319 -1.474157 1.382165
C -2.235943 0.841852 1.285082
C -3.730062 -2.552016 0.479214
C -3.561486 1.603820 1.321969
C 1.910963 3.953436 1.103987
C 2.179532 -2.263487 2.490551
H 0.541789 -0.574100 -3.005911
H 0.763182 -1.783034 -1.735655
H -1.053288 0.726867 -1.367734
H 0.741273 1.810287 -2.274362
H 2.383006 1.362745 -2.794013
H 3.562661 0.213222 -0.570800
H 3.274749 -0.950609 -1.892793
H -0.227853 -0.720712 0.711341
H -1.118610 -2.074849 -0.031265
H 3.265790 2.157791 -0.514798
H 2.568837 3.425238 -1.534065
H 1.989389 -2.441593 -0.294521
H 3.671106 -2.182718 0.185251
H 1.100110 1.965147 0.758399
H 0.377243 3.226333 -0.248007
H 2.870413 -0.329215 1.783290
H 1.202652 -0.703884 1.322858
H -3.947324 -0.962237 1.934730
H -2.471112 -1.938668 2.149203
H -1.478549 1.454280 0.743983
H -1.845747 0.699499 2.315737
H -2.660195 -0.987462 -1.943181
H -4.302029 -3.279780 1.063234
H -2.959833 -3.098654 -0.078520
H -4.406575 -2.109255 -0.263170
H -3.424073 2.612359 1.724206
H -4.311601 1.094019 1.936951
H -3.987007 1.696647 0.313437
H 1.206539 4.201296 1.905599
H 2.841956 3.622038 1.577385
H 2.130391 4.880287 0.562422
H 1.825563 -1.882960 3.455060
H 1.510750 -3.078899 2.193468
H 3.171596 -2.698808 2.655906


%chk=000235054-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000235054

0 1
O -2.008730 -0.658208 -2.092188
N 1.568596 0.122940 -1.218277
N -2.607588 -0.331022 0.510550
C 0.406396 -0.538814 -1.869461
C -0.936549 -0.052212 -1.298304
C 1.865168 1.461917 -1.801759
C 2.774185 -0.747323 -1.153374
C -1.154746 -0.457803 0.184056
C 2.502509 2.444609 -0.793139
C 2.690215 -1.842290 -0.065732
C 1.555074 2.834620 0.362678
C 2.652826 -1.280261 1.372647
C -3.093223 -1.375599 1.459568
C -2.972780 1.056516 0.926117
C -3.271506 -2.751965 0.792052
C -4.453371 1.394880 0.672387
C 2.215313 3.779995 1.388392
C 2.476813 -2.379855 2.441604
H 0.394126 -0.379489 -2.973783
H 0.466003 -1.630707 -1.709651
H -0.992105 1.057777 -1.383010
H 0.913120 1.897680 -2.160261
H 2.525201 1.366974 -2.700735
H 3.644561 -0.101518 -0.929164
H 2.979469 -1.223124 -2.146157
H -0.509182 0.147125 0.855472
H -0.864629 -1.518127 0.300017
H 3.429458 2.004459 -0.371694
H 2.814043 3.357361 -1.343173
H 1.793997 -2.473351 -0.235859
H 3.565674 -2.515283 -0.179951
H 1.214515 1.906833 0.861314
H 0.649173 3.318550 -0.059119
H 3.589612 -0.718020 1.567074
H 1.828067 -0.545439 1.439279
H -4.070920 -1.043750 1.853322
H -2.408521 -1.462448 2.337700
H -2.344135 1.751843 0.339841
H -2.718213 1.226438 2.000559
H -2.774137 -0.684509 -1.431483
H -3.630831 -3.492218 1.530866
H -2.324664 -3.130970 0.368169
H -4.006373 -2.689288 -0.029613
H -4.664112 2.438187 0.972107
H -5.133838 0.740191 1.246220
H -4.694812 1.282460 -0.399215
H 1.515924 4.048565 2.201779
H 3.102641 3.306002 1.849685
H 2.550506 4.719245 0.908111
H 2.465605 -1.955110 3.462505
H 1.526187 -2.927375 2.293283
H 3.298191 -3.120190 2.393340


