%chk=000274747.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000274747

0 1
O -3.949777 -1.327031 0.825181
O -3.696396 2.078512 1.203913
O -5.379251 0.928957 -1.440664
O -7.218545 -1.974027 -0.432887
N -1.751079 -0.665319 0.348303
N -0.116547 -1.971921 -0.598538
N -0.504125 1.512026 0.420152
N 2.614785 -0.738131 -1.379925
N 1.772058 1.307249 -0.467004
C -3.619097 1.009416 0.271451
C -3.024045 -0.247158 0.976848
C -5.067706 0.598595 -0.087583
C -5.059363 -0.946442 -0.046777
C -6.297104 -1.592142 0.587616
C -0.648350 0.172042 0.140342
C -1.366252 -1.965428 -0.125675
C 0.363282 -0.658080 -0.449358
C 1.615520 -0.036637 -0.763125
C 4.951187 -0.618299 -0.530741
C 3.966601 -0.182029 -1.627399
C 6.366192 -0.113992 -0.838371
C 7.358669 -0.544569 0.249925
C 0.727841 1.992099 0.089977
C 8.776827 -0.040646 -0.053182
C 9.768841 -0.466833 1.026477
H -3.043205 1.324519 -0.628179
H -2.881399 -0.115410 2.079085
H -5.801643 1.076243 0.596941
H -4.851848 -1.372896 -1.057142
H -6.031546 -2.556764 1.072188
H -6.797667 -0.942191 1.325563
H -2.792940 2.488626 1.304871
H -5.452293 1.904379 -1.546085
H -2.055351 -2.800376 -0.076349
H -7.511064 -1.187670 -0.945596
H 4.954307 -1.720345 -0.427431
H 4.612937 -0.224657 0.449832
H 3.916338 0.933231 -1.679029
H 4.301145 -0.537563 -2.628144
H 6.361814 0.990795 -0.924869
H 6.700660 -0.494767 -1.822863
H 2.487495 -1.742908 -1.512844
H 7.028469 -0.162379 1.235432
H 7.365056 -1.647615 0.343244
H 0.914355 3.060744 0.294487
H 8.773300 1.063616 -0.141676
H 9.110402 -0.421994 -1.038132
H 10.777939 -0.102531 0.802964
H 9.489292 -0.073030 2.010431
H 9.826581 -1.557671 1.115143


%chk=000274747-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000274747

0 1
O -4.065461 -1.509661 0.538088
O -3.107710 2.039161 0.755045
O -5.908883 1.444795 -0.626793
O -7.693540 -0.908367 -0.302328
N -1.759732 -0.916342 0.158479
N -0.069527 -2.253604 -0.625526
N -0.570910 1.280304 0.140423
N 2.670479 -1.020566 -1.327865
N 1.741728 1.063375 -0.647552
C -3.564987 0.836784 0.110550
C -3.039715 -0.481741 0.757409
C -5.077786 0.641116 0.265115
C -5.257718 -0.847704 -0.093856
C -6.555379 -1.464812 0.436636
C -0.664561 -0.076000 -0.057604
C -1.345257 -2.213020 -0.190900
C 0.366523 -0.918920 -0.540648
C 1.618339 -0.297859 -0.845774
C 5.020768 -0.726913 -0.471714
C 4.004271 -0.460794 -1.607118
C 6.412480 -0.134950 -0.787641
C 7.445709 -0.393320 0.332052
C 0.670024 1.761265 -0.181652
C 8.835463 0.212856 0.030937
C 9.862243 -0.048145 1.154036
H -3.312334 0.820339 -0.973559
H -2.895890 -0.340954 1.847097
H -5.353287 0.824199 1.326155
H -5.209948 -0.969264 -1.194186
H -6.576610 -2.552295 0.259453
H -6.641849 -1.278108 1.528231
H -2.092264 2.052614 0.603262
H -5.715051 2.402745 -0.463137
H -2.021552 -3.059686 -0.119087
H -7.539259 0.065591 -0.446500
H 5.112165 -1.819195 -0.299667
H 4.628901 -0.285487 0.465159
H 3.877420 0.625516 -1.748634
H 4.374911 -0.893976 -2.556304
H 6.316652 0.958407 -0.952168
H 6.791616 -0.562301 -1.740015
H 2.517230 -2.027525 -1.424819
H 7.064128 0.024497 1.286909
H 7.551036 -1.486900 0.491558
H 0.819854 2.836405 -0.047668
H 8.729149 1.305482 -0.127832
H 9.216346 -0.204024 -0.923977
H 10.846090 0.395098 0.913877
H 9.520801 0.386616 2.112406
H 10.010183 -1.133134 1.312447


