%chk=000214803.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214803

0 1
O -0.338515 -0.869628 -0.034573
N -3.805500 -1.992795 -0.335241
C 1.930168 -0.159878 0.326920
C 0.617072 0.142567 -0.473115
C 2.249769 -1.663033 0.646458
C 3.078717 0.599223 -0.372303
C 0.750529 -0.069181 -2.002191
C 3.266346 0.188743 -1.834596
C 2.010135 0.518860 -2.643424
C 0.104508 1.535778 -0.074592
C 1.336390 -2.138663 1.799638
C 2.056563 -2.591761 -0.561102
C 3.708778 -1.802810 1.143734
C -0.464260 1.801419 1.191664
C -1.693853 -0.766162 -0.543666
C 0.226626 2.604178 -0.977113
C -2.448200 -1.825534 0.276642
C -0.913051 3.100759 1.498931
C -0.615964 0.777869 2.271265
C -0.216593 3.890697 -0.666804
C -0.796154 4.140505 0.579146
C -4.749977 -0.951494 0.168879
C -4.343793 -3.357727 -0.057403
H 1.809657 0.322620 1.333307
H 4.024492 0.463575 0.183351
H 2.865830 1.687437 -0.318570
H -0.146194 0.328314 -2.513943
H 0.729410 -1.167352 -2.178545
H 3.474379 -0.903263 -1.893603
H 4.146609 0.697566 -2.266642
H 1.902333 1.622510 -2.734132
H 2.110348 0.138361 -3.677533
H 1.550489 -1.611562 2.732363
H 0.275742 -1.970718 1.555002
H 1.459932 -3.208205 1.988400
H 2.693596 -2.284634 -1.402512
H 1.010753 -2.565390 -0.901674
H 2.299749 -3.628644 -0.316770
H 3.920644 -1.124153 1.974414
H 3.901204 -2.820627 1.498489
H 4.431714 -1.600141 0.348067
H -2.079784 0.253266 -0.384915
H -1.696295 -1.007986 -1.619720
H 0.693856 2.445846 -1.955137
H -1.881705 -2.782062 0.221595
H -2.467534 -1.540422 1.348592
H -1.354363 3.295653 2.474756
H 0.109695 0.948040 3.077657
H -1.617306 0.802226 2.717986
H -0.458417 -0.255634 1.903983
H -0.109044 4.693285 -1.392069
H -1.149155 5.138366 0.831297
H -4.347326 0.046860 -0.066253
H -4.955578 -0.994078 1.248157
H -5.706154 -1.048567 -0.370047
H -5.323928 -3.462440 -0.550170
H -4.465606 -3.601956 1.007534
H -3.674483 -4.105219 -0.513570


%chk=000214803-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000214803

0 1
O -0.376158 -0.979724 -0.009789
N -3.971450 -1.939273 -0.412431
C 1.962556 -0.220781 0.360911
C 0.619522 0.066713 -0.434257
C 2.387203 -1.739786 0.637767
C 3.072917 0.672074 -0.278665
C 0.837050 -0.108137 -1.974183
C 3.359376 0.357414 -1.760939
C 2.080901 0.582211 -2.596004
C 0.047804 1.466458 -0.036411
C 1.588798 -2.279087 1.864148
C 2.164981 -2.743359 -0.529019
C 3.893212 -1.794696 1.034423
C -0.360885 1.781392 1.306355
C -1.712782 -0.885996 -0.621929
C -0.133821 2.469751 -1.027947
C -2.618918 -1.833041 0.182408
C -0.875207 3.076786 1.580993
C -0.310294 0.814410 2.484375
C -0.646202 3.751474 -0.737019
C -1.011862 4.066917 0.587035
C -4.802711 -0.738477 -0.187190
C -4.673231 -3.173010 -0.004672
H 1.816151 0.191980 1.376185
H 3.997669 0.598363 0.318480
H 2.745434 1.729606 -0.205336
H -0.069997 0.216476 -2.519301
H 0.921184 -1.194031 -2.146881
H 3.717634 -0.683235 -1.871247
H 4.170399 1.011111 -2.137416
H 1.918839 1.673533 -2.682726
H 2.215683 0.202823 -3.628079
H 1.774172 -1.660911 2.763935
H 0.508340 -2.280766 1.654150
H 1.906672 -3.314206 2.096058
H 2.707647 -2.459752 -1.447565
H 1.091279 -2.836571 -0.761418
H 2.536299 -3.740533 -0.221470
H 4.124115 -1.098702 1.863542
H 4.141483 -2.816672 1.378967
H 4.562140 -1.558178 0.187246
H -2.077149 0.160038 -0.583049
H -1.692108 -1.218354 -1.678370
H 0.121167 2.252469 -2.066958
H -2.153033 -2.835828 0.169643
H -2.646966 -1.497043 1.250263
H -1.184688 3.302115 2.609561
H 0.635378 0.918423 3.051897
H -1.131267 1.037731 3.189601
H -0.397045 -0.230830 2.158927
H -0.761043 4.489009 -1.539316
H -1.411031 5.055550 0.840025
H -4.299648 0.159927 -0.582999
H -5.026530 -0.558721 0.896086
H -5.763326 -0.849171 -0.721515
H -5.635750 -3.245880 -0.542799
H -4.890600 -3.222319 1.093279
H -4.065003 -4.054883 -0.273061


