%chk=000212371.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212371

0 1
O 0.072417 -1.949386 0.745850
O -5.403571 0.667115 -0.986594
N 2.890186 -0.081500 -0.121261
C 2.031785 0.893721 0.652311
C 0.746589 0.221772 1.222831
C 1.635945 2.064314 -0.277468
C -0.093269 1.279188 1.962791
C 0.860852 3.128570 0.505758
C -0.402555 2.533949 1.137664
C -0.003828 -0.611785 0.153964
C 3.204785 -1.315154 0.677228
C 4.174052 0.574330 -0.553077
C 4.001934 -2.311051 -0.182180
C 4.978218 -0.382210 -1.448371
C 5.299471 -1.685084 -0.706626
C -1.453923 -0.280706 -0.103745
C -1.811613 0.464786 -1.242267
C -2.453144 -0.740532 0.762438
C -0.144185 -3.023543 -0.186201
C -3.143666 0.764606 -1.503553
C -3.801453 -0.457008 0.522748
C -4.129251 0.297919 -0.609040
C -6.505427 0.243534 -0.149538
H 2.597961 1.311074 1.527773
H 1.068363 -0.526720 2.003997
H 1.027167 1.682415 -1.119036
H 2.535378 2.514937 -0.741757
H 0.448860 1.574999 2.883222
H -1.041109 0.822471 2.308666
H 0.588314 3.964696 -0.165306
H 1.506366 3.566756 1.290734
H -0.894857 3.287963 1.780258
H -1.137676 2.291087 0.345345
H 0.567900 -0.626986 -0.805623
H 2.240949 -1.795670 0.976236
H 3.761842 -1.087628 1.610103
H 4.796125 0.898079 0.309042
H 3.919555 1.491661 -1.131481
H 3.375305 -2.636810 -1.036194
H 4.220143 -3.217123 0.410999
H 5.906290 0.113577 -1.784066
H 4.392495 -0.608731 -2.361668
H 5.993573 -1.486508 0.131326
H 5.821115 -2.390292 -1.378752
H -1.038101 0.814840 -1.927330
H -2.166640 -1.340055 1.630486
H -1.142144 -2.951965 -0.629501
H -0.060108 -3.916224 0.443041
H 0.631343 -3.015275 -0.958696
H -3.441061 1.342083 -2.374870
H -4.560527 -0.821426 1.204755
H -7.367189 0.668889 -0.680056
H -6.410003 0.673948 0.851309
H -6.563175 -0.848207 -0.120521


%chk=000212371-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212371

0 1
O 0.215321 -1.900993 0.449978
O -5.592516 0.461551 -1.038866
N 2.897817 -0.122790 0.055152
C 2.073160 0.919169 0.753675
C 0.697505 0.323109 1.230926
C 1.843868 2.186303 -0.110384
C -0.139275 1.421073 1.944406
C 1.022964 3.258227 0.645239
C -0.338507 2.706728 1.113620
C -0.001783 -0.473509 0.076776
C 3.354491 -1.179360 1.002673
C 4.048688 0.402003 -0.728127
C 4.054660 -2.346084 0.277722
C 4.760137 -0.723285 -1.509899
C 5.244273 -1.843536 -0.566789
C -1.486459 -0.228110 -0.176090
C -1.917954 0.473650 -1.331951
C -2.475087 -0.730290 0.703623
C 0.018833 -2.815045 -0.675098
C -3.283717 0.690986 -1.592563
C -3.852044 -0.527192 0.460916
C -4.257096 0.194344 -0.690628
C -6.636694 -0.033855 -0.140479
H 2.604397 1.261841 1.684338
H 0.901715 -0.448914 1.997614
H 1.323743 1.907219 -1.050315
H 2.811245 2.634486 -0.399272
H 0.392428 1.689593 2.881949
H -1.117405 1.004557 2.246376
H 0.881800 4.142765 -0.006063
H 1.604172 3.601174 1.526928
H -0.871662 3.465939 1.718547
H -0.976182 2.493465 0.235063
H 0.561401 -0.286003 -0.863012
H 2.475862 -1.573593 1.535554
H 4.058421 -0.743592 1.762654
H 4.797352 0.911933 -0.062547
H 3.686962 1.150318 -1.451804
H 3.315871 -2.845622 -0.378888
H 4.389205 -3.088964 1.027826
H 5.607720 -0.288770 -2.075229
H 4.047064 -1.144677 -2.245935
H 6.033686 -1.445876 0.104744
H 5.697181 -2.672843 -1.143147
H -1.171214 0.850715 -2.042765
H -2.157555 -1.313563 1.575486
H -1.026383 -2.792611 -1.045817
H 0.250834 -3.823456 -0.295055
H 0.705751 -2.565361 -1.511176
H -3.619973 1.230339 -2.483412
H -4.588805 -0.933486 1.160774
H -7.584590 0.288203 -0.596332
H -6.541180 0.406311 0.871527
H -6.615642 -1.138921 -0.066347


