%chk=000296688.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296688

0 1
O -0.641504 0.677661 -2.068113
N -1.584090 -1.059276 0.159764
C -0.474565 -0.954105 1.162158
C -0.819039 0.218597 0.249134
C -2.990956 -1.106439 0.635076
C 0.723638 -1.816263 0.949231
C -0.059920 0.595058 -1.007215
C -3.761116 0.179783 0.465804
C 0.894883 -2.564188 -0.224942
C 1.697379 -1.874162 1.960376
C 1.382457 0.932230 -0.871022
C 2.030357 -3.362726 -0.385012
C 2.831496 -2.672178 1.792142
C -4.586236 0.641206 1.501118
C -3.681260 0.900858 -0.735855
C 1.990377 1.174183 0.369491
C 2.151911 1.023716 -2.044650
C 3.000200 -3.417819 0.620690
C -5.327937 1.814752 1.333152
C -4.421657 2.073658 -0.896294
C 3.343569 1.504982 0.438066
C 3.505689 1.347274 -1.979378
C 4.112038 1.591651 -0.735482
C -5.247340 2.532296 0.136268
C 5.565331 1.925104 -0.660405
H -0.727450 -0.834037 2.230941
H -1.274665 1.116992 0.705058
H -3.059876 -1.484270 1.678531
H -3.467229 -1.894732 -0.007594
H 0.135476 -2.521857 -1.010146
H 1.574679 -1.299550 2.875519
H 2.158706 -3.942120 -1.298047
H 3.585508 -2.713759 2.575850
H -4.657948 0.089024 2.435414
H -3.026088 0.548823 -1.542273
H 1.408265 1.103990 1.288979
H 1.671788 0.839589 -3.010764
H 3.883988 -4.039071 0.492616
H -5.970064 2.168687 2.137562
H -4.355238 2.630653 -1.830196
H 3.806158 1.690352 1.404858
H 4.092061 1.409912 -2.893739
H -5.825599 3.444683 0.006852
H 5.916811 2.467767 -1.548729
H 5.810422 2.545880 0.211849
H 6.168790 1.007189 -0.583745


%chk=000296688-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000296688

0 1
O -0.061178 -0.120329 -1.747758
N -1.428188 -0.852159 0.700122
C -0.205715 -1.259949 1.446032
C -0.279627 0.092642 0.660234
C -2.615406 -0.440602 1.488027
C 0.574456 -2.453531 0.998129
C 0.416884 0.324475 -0.661410
C -3.546162 0.460387 0.680934
C 0.350967 -3.053255 -0.268701
C 1.559001 -2.999876 1.861811
C 1.695369 1.104463 -0.636496
C 1.105005 -4.180688 -0.658680
C 2.314323 -4.125591 1.467564
C -4.570370 1.178642 1.348726
C -3.423911 0.577994 -0.726022
C 2.387582 1.403042 0.567724
C 2.249138 1.545395 -1.868767
C 2.089238 -4.719307 0.203787
C -5.467398 1.994398 0.624511
C -4.319715 1.399263 -1.449128
C 3.598943 2.123159 0.535442
C 3.453892 2.269607 -1.893866
C 4.153620 2.569445 -0.692612
C -5.344220 2.107522 -0.780487
C 5.471272 3.320701 -0.726683
H -0.216375 -1.106637 2.540292
H -0.330266 0.978686 1.315558
H -2.330887 0.078197 2.438030
H -3.142666 -1.371277 1.776027
H -0.418132 -2.628582 -0.921581
H 1.731620 -2.544554 2.845813
H 0.925212 -4.640276 -1.637007
H 3.070473 -4.541223 2.143229
H -4.668539 1.100082 2.439707
H -2.628337 0.028508 -1.240947
H 1.993348 1.055989 1.528959
H 1.710479 1.304096 -2.791310
H 2.671872 -5.595182 -0.103518
H -6.255781 2.542486 1.153225
H -4.214226 1.484699 -2.536709
H 4.125698 2.341930 1.472114
H 3.863973 2.609700 -2.852476
H -6.036863 2.742324 -1.344803
H 5.500923 4.049065 -1.555973
H 5.654779 3.863872 0.216611
H 6.318094 2.622247 -0.874781


