%chk=000180319.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180319

0 1
N -1.455916 -0.876518 0.775895
C -0.713540 0.181272 -0.004228
C -1.237619 0.157670 -1.470548
C -0.896267 1.598699 0.607215
C 0.767180 -0.213323 -0.057013
C -2.756699 0.325397 -1.560572
C -2.944596 -0.696310 0.741501
C 0.101242 2.598137 0.022252
C -3.451167 -0.741414 -0.708285
C 1.534564 2.182653 0.366971
C 1.800791 0.729066 0.084181
C -0.994092 -0.991357 2.191721
C 1.099437 -1.557425 -0.302764
C 3.141133 0.313332 -0.015554
C 2.429920 -1.963984 -0.398477
C 3.455646 -1.023438 -0.255020
H -0.948317 -0.804041 -1.940127
H -0.724317 0.947634 -2.049188
H -0.771063 1.552246 1.705785
H -1.930988 1.947750 0.433794
H -3.082953 0.245360 -2.614297
H -3.053025 1.337662 -1.224769
H -3.277376 0.242955 1.232652
H -3.395973 -1.535788 1.315155
H -0.103174 3.614042 0.408340
H -0.020604 2.657889 -1.077931
H -4.546974 -0.603492 -0.725964
H -3.254383 -1.745580 -1.135088
H 1.734277 2.374459 1.443181
H 2.250906 2.821027 -0.188667
H 0.101329 -1.119548 2.214157
H -1.432650 -1.901540 2.630909
H -1.249820 -0.135037 2.833027
H 0.297161 -2.292888 -0.408815
H 3.941283 1.041985 0.094502
H 2.668613 -3.008082 -0.585320
H 4.495431 -1.334169 -0.331113


%chk=000180319-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000180319

0 1
N -1.475455 -0.828310 0.799588
C -0.718456 0.208349 0.000127
C -1.259751 0.146826 -1.471832
C -0.885724 1.647602 0.590344
C 0.775037 -0.193226 -0.051919
C -2.792881 0.287314 -1.581537
C -2.952846 -0.707126 0.736361
C 0.138418 2.653964 0.024955
C -3.476138 -0.786027 -0.709553
C 1.566101 2.219003 0.408210
C 1.831961 0.749536 0.094010
C -1.016206 -1.006054 2.192999
C 1.099049 -1.551395 -0.312521
C 3.174775 0.305072 -0.030951
C 2.434571 -1.983119 -0.426048
C 3.485486 -1.045084 -0.287841
H -0.961646 -0.830910 -1.894813
H -0.749944 0.921428 -2.073966
H -0.755672 1.604198 1.690425
H -1.913925 2.009236 0.407324
H -3.098963 0.182362 -2.640272
H -3.119940 1.295972 -1.258625
H -3.319611 0.240275 1.211083
H -3.376114 -1.538630 1.332671
H -0.066511 3.666621 0.422814
H 0.046996 2.717494 -1.076455
H -4.576057 -0.659477 -0.712082
H -3.250269 -1.790381 -1.117487
H 1.707900 2.385009 1.497320
H 2.319044 2.850979 -0.100739
H 0.081279 -1.105614 2.220817
H -1.453716 -1.936976 2.599782
H -1.307248 -0.174011 2.881165
H 0.271633 -2.265905 -0.392356
H 3.985061 1.037856 0.077615
H 2.656893 -3.038317 -0.621560
H 4.530268 -1.363232 -0.379551


