%chk=000208689.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208689

0 1
O 2.791174 2.093763 -0.916985
O 1.142038 -1.521948 0.045122
O -3.491110 2.680151 -0.090861
N 2.985543 -0.248263 0.458487
N -3.424804 0.532848 -0.855513
N 4.351754 -3.090948 -2.614320
N -5.969906 -1.993355 2.084931
C 0.891540 0.808666 -0.328867
C -1.331651 1.780699 -0.581025
C -0.507706 0.713249 -0.220072
C 3.812829 -1.443266 0.754574
C -4.889218 0.354101 -0.703599
C 1.426857 2.016588 -0.810475
C 1.666797 -0.413930 0.038900
C -2.819678 1.725510 -0.456965
C -0.765241 2.985105 -1.044180
C 0.613602 3.107189 -1.170400
C 4.516150 -1.949108 -0.478055
C -5.240804 -0.163753 0.666981
C 5.892855 -1.782454 -0.660380
C -5.178633 0.686907 1.781740
C 3.778801 -2.612668 -1.484573
C -5.639454 -1.498992 0.863870
C 6.494442 -2.276650 -1.822420
C -5.513797 0.188304 3.040874
C 5.692418 -2.923687 -2.774874
C -5.905517 -1.157343 3.152770
H -0.930577 -0.226971 0.160083
H 3.152155 -2.248722 1.171425
H 4.533784 -1.176404 1.559635
H -5.393861 1.340714 -0.875706
H -5.246428 -0.330373 -1.505586
H -1.423568 3.823553 -1.298566
H 3.491533 0.620953 0.289431
H -2.885122 -0.300243 -1.066506
H 1.053756 4.031435 -1.535242
H 6.495481 -1.276358 0.092668
H -4.864124 1.729156 1.653456
H 2.691034 -2.761169 -1.378904
H -5.703689 -2.207380 0.030213
H 7.563000 -2.163246 -1.985554
H -5.473786 0.826648 3.920388
H 3.096859 2.956306 -1.301262
H 6.117735 -3.327796 -3.700489
H -6.178662 -1.593020 4.120733


%chk=000208689-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208689

0 1
O 2.732233 2.015489 -0.763336
O 1.001310 -1.802947 0.068034
O -3.709327 2.385510 -1.001303
N 2.977597 -0.597292 -0.172195
N -3.533058 0.161361 -0.355327
N 5.705744 -1.858836 -3.258552
N -6.908481 -1.372154 2.697601
C 0.807070 0.554891 -0.453798
C -1.476244 1.487273 -0.693215
C -0.601181 0.409477 -0.436716
C 3.834423 -1.758705 0.098179
C -4.990946 -0.056167 -0.360401
C 1.332893 1.844782 -0.743212
C 1.601438 -0.701020 -0.165346
C -2.980140 1.385044 -0.695012
C -0.918458 2.759962 -0.982236
C 0.473455 2.938215 -1.006221
C 4.959804 -1.912968 -0.915418
C -5.598897 -0.120362 1.034816
C 6.259401 -2.304014 -0.510829
C -5.473310 0.963879 1.941110
C 4.743216 -1.702391 -2.303074
C -6.325689 -1.256920 1.466534
C 7.268935 -2.475984 -1.483697
C -6.068105 0.865655 3.216231
C 6.949169 -2.243750 -2.840693
C -6.772539 -0.315919 3.551558
H -0.943424 -0.609799 -0.220671
H 3.166237 -2.641173 0.090134
H 4.263171 -1.691467 1.118882
H -5.419395 0.793558 -0.922522
H -5.217620 -0.986410 -0.914418
H -1.604279 3.587749 -1.187538
H 3.396108 0.321684 -0.359204
H -2.935563 -0.605316 -0.045123
H 0.896979 3.925798 -1.230593
H 6.477609 -2.471662 0.551014
H -4.926124 1.864531 1.640524
H 3.755873 -1.393821 -2.666020
H -6.452070 -2.120762 0.800453
H 8.281973 -2.778700 -1.200355
H -5.995010 1.684349 3.939165
H 2.984804 2.939062 -1.007543
H 7.701949 -2.365492 -3.627831
H -7.246727 -0.430438 4.533069


