%chk=000270388.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270388

0 1
O 1.215358 1.869741 -1.693094
O -1.540672 2.371666 0.781452
O 2.475368 3.508627 -0.835492
O 5.677784 -2.297847 -0.724136
N 0.249701 0.940878 0.560737
N -2.006427 0.202082 0.098698
C 1.185245 2.074234 0.702986
C 2.380578 1.665716 1.590029
C 3.238344 0.591818 0.982847
C -1.134894 1.260279 0.480945
C 1.714630 2.592890 -0.638325
C -3.439777 0.396810 0.027128
C -1.503162 -1.143554 -0.121741
C 4.322522 0.942943 0.154840
C 2.969659 -0.758833 1.242041
C 5.130429 -0.037349 -0.409554
C 3.765762 -1.764181 0.686386
C -4.291691 -0.691346 0.296303
C -1.594633 -1.699482 -1.408120
C -3.973701 1.646713 -0.332971
C -0.939006 -1.868210 0.941260
C 4.837597 -1.385044 -0.132165
C -5.673088 -0.520621 0.189784
C -1.110529 -2.991467 -1.624960
C -5.358125 1.796410 -0.426671
C -0.456902 -3.157165 0.703848
C -6.211470 0.717891 -0.172043
C -0.541297 -3.719370 -0.574433
H 0.637047 2.942166 1.191910
H 2.989170 2.572901 1.804322
H 1.989082 1.337794 2.578507
H 0.622114 0.151803 0.021549
H 4.528716 1.997026 -0.050647
H 2.130631 -1.034052 1.882901
H 5.973861 0.210584 -1.050963
H 3.555576 -2.808627 0.888783
H -3.888069 -1.658414 0.590583
H -2.042410 -1.128769 -2.222186
H -3.317480 2.501599 -0.515397
H -0.882757 -1.428260 1.937109
H -6.334537 -1.361602 0.395897
H -1.177026 -3.432324 -2.619821
H -5.773744 2.766153 -0.700875
H -0.019344 -3.728598 1.522098
H -7.288664 0.843660 -0.250423
H -0.166515 -4.726161 -0.751894
H 1.544417 2.199146 -2.574005
H 5.439228 -3.228354 -0.493727


%chk=000270388-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270388

0 1
O 1.302404 1.944994 -2.065707
O -1.528223 2.520182 0.798554
O 2.689632 3.507074 -1.060656
O 5.561638 -2.683189 -0.293528
N 0.215583 1.096455 0.225897
N -2.017423 0.289861 0.139505
C 1.198554 2.162593 0.373843
C 2.345169 1.807516 1.382772
C 3.186122 0.610601 0.965266
C -1.141049 1.374448 0.409750
C 1.812239 2.623062 -0.953599
C -3.459690 0.398310 0.153030
C -1.442537 -1.012516 -0.165805
C 4.373355 0.784633 0.202353
C 2.803128 -0.710218 1.310872
C 5.149564 -0.317069 -0.207984
C 3.568001 -1.826271 0.905207
C -4.233685 -0.795432 0.106247
C -1.263230 -1.405921 -1.512993
C -4.134365 1.651728 0.178295
C -1.077678 -1.884420 0.887764
C 4.743077 -1.624741 0.143339
C -5.642777 -0.736094 0.084357
C -0.715374 -2.675548 -1.805022
C -5.544406 1.691044 0.157134
C -0.530701 -3.153234 0.591050
C -6.313127 0.506465 0.109445
C -0.349921 -3.550363 -0.754916
H 0.643993 3.033280 0.779185
H 2.978316 2.706739 1.483692
H 1.858748 1.623653 2.357346
H 0.514266 0.215617 -0.194863
H 4.694158 1.797467 -0.067260
H 1.899986 -0.869631 1.911851
H 6.067187 -0.185252 -0.788461
H 3.252982 -2.840137 1.184829
H -3.742896 -1.771925 0.084070
H -1.556654 -0.719398 -2.313633
H -3.556627 2.573609 0.235784
H -1.236858 -1.565055 1.923255
H -6.214434 -1.670384 0.048509
H -0.573854 -2.980071 -2.847454
H -6.043168 2.666787 0.177152
H -0.256591 -3.832224 1.406006
H -7.407215 0.550476 0.092581
H 0.069417 -4.535979 -0.984731
H 1.750635 2.293663 -2.884176
H 5.211228 -3.553284 0.021148


