%chk=000202268.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202268

0 1
O -2.104260 0.247368 0.444609
N -5.701648 -0.012799 0.225813
C 0.020726 -0.625403 -0.032712
C 0.853282 0.425290 0.779393
C 2.390890 -0.780957 -0.969751
C 0.927252 -1.302801 -1.095074
C 1.491344 1.375738 -0.216802
C 1.990174 -0.352889 1.417036
C 2.327419 0.724146 -1.163773
C 2.821150 -1.010534 0.469085
C -1.208681 0.028581 -0.674444
C 1.315997 2.751415 -0.264570
C 2.247687 -0.465906 2.775321
C 2.981025 1.454222 -2.145714
C 3.900660 -1.773079 0.890023
C 1.981382 3.488069 -1.260823
C 3.344346 -1.239061 3.197638
C 2.802566 2.848773 -2.188036
C 4.158925 -1.883491 2.268485
C -3.403604 0.758668 0.092557
C -4.342299 -0.419065 -0.283992
C -4.290992 -0.686697 -1.791058
C -5.886395 -0.491386 1.631306
C -6.843732 -0.472489 -0.614429
H -0.342240 -1.395675 0.692302
H 0.204028 0.940549 1.515784
H 3.055387 -1.280573 -1.699993
H 0.562995 -1.110611 -2.118710
H 0.913607 -2.397737 -0.958237
H -1.702663 -0.635498 -1.410068
H -0.982852 1.001103 -1.144653
H 0.677734 3.258010 0.455603
H 1.617157 0.033287 3.507141
H 3.625317 0.965441 -2.871700
H 4.543502 -2.277844 0.173769
H 1.852068 4.567891 -1.302013
H 3.554548 -1.330304 4.261536
H 3.314681 3.429445 -2.952659
H 5.005395 -2.477839 2.606731
H -3.335364 1.519238 -0.698030
H -3.713191 1.251165 1.035496
H -3.960549 -1.336544 0.241132
H -3.250199 -0.855821 -2.109111
H -4.680375 0.157119 -2.372479
H -4.862434 -1.578137 -2.069579
H -5.041614 -0.150473 2.251725
H -5.972131 -1.582446 1.738803
H -6.796682 -0.028853 2.045225
H -6.887615 -1.557330 -0.786564
H -6.801508 0.040562 -1.588690
H -7.787616 -0.162337 -0.136448


%chk=000202268-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202268

0 1
O -2.163929 0.345593 0.206696
N -5.364349 -0.302534 0.295655
C -0.025579 -0.779671 -0.008847
C 0.724912 0.356921 0.799258
C 2.433172 -0.871065 -0.767892
C 0.991180 -1.474914 -0.978908
C 1.377041 1.282994 -0.222856
C 1.838893 -0.353356 1.563213
C 2.311627 0.621100 -1.067320
C 2.763228 -1.024046 0.714980
C -1.239943 -0.237578 -0.774520
C 1.125776 2.658923 -0.386243
C 1.994048 -0.406492 2.961297
C 2.995665 1.335762 -2.068953
C 3.841459 -1.742625 1.264363
C 1.818569 3.381402 -1.390409
C 3.081334 -1.127591 3.516580
C 2.749915 2.723228 -2.227212
C 4.001028 -1.792141 2.672301
C -3.337163 0.994534 -0.399509
C -4.469377 0.030577 -0.853164
C -5.255665 0.704165 -2.001895
C -4.653871 -0.981018 1.407843
C -6.562992 -1.082167 -0.087277
H -0.395582 -1.511024 0.733859
H 0.012252 0.879761 1.456323
H 3.168195 -1.374146 -1.419800
H 0.695675 -1.317183 -2.034061
H 1.018059 -2.563938 -0.797393
H -1.732017 -1.063158 -1.333849
H -0.925531 0.541678 -1.504925
H 0.401683 3.166146 0.262202
H 1.280347 0.108224 3.615319
H 3.717494 0.825656 -2.718149
H 4.554994 -2.257238 0.609522
H 1.634965 4.454481 -1.516932
H 3.211875 -1.167865 4.603995
H 3.285358 3.288767 -2.998396
H 4.841310 -2.344533 3.108196
H -3.000380 1.603669 -1.265513
H -3.737276 1.668105 0.378577
H -3.991020 -0.902338 -1.259852
H -4.561234 1.014947 -2.803434
H -5.784185 1.601280 -1.629767
H -5.998395 0.027264 -2.455641
H -3.780484 -0.393630 1.725687
H -4.285427 -2.001519 1.129187
H -5.344826 -1.085608 2.263969
H -6.319171 -2.057048 -0.584135
H -7.214855 -0.502669 -0.760643
H -7.144202 -1.306581 0.824873


