%chk=000213316.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213316

0 1
N -0.903249 -0.159802 -0.093906
N 1.983206 -0.367920 -0.063839
N 3.763801 -1.517754 1.089575
N 4.311645 1.599353 -0.943688
N 6.106967 -0.824666 1.002273
N 6.498832 1.252254 -0.343911
C -0.032001 1.008343 -0.455988
C -0.209835 -1.429485 -0.499268
C -2.256743 -0.050310 -0.755659
C 1.290085 0.903694 0.329373
C 1.123684 -1.556197 0.259629
C -2.949358 1.240855 -0.342195
C -3.143995 -1.218391 -0.347569
C 3.343278 -0.466268 0.339618
C 4.321711 0.458261 -0.130456
C -3.587812 2.016587 -1.320908
C -3.942202 -1.838076 -1.320525
C -2.978783 1.653192 0.998187
C -3.194890 -1.666840 0.980292
C 5.713418 0.243107 0.232545
C -4.248800 3.194206 -0.959212
C -4.782691 -2.897068 -0.965278
C -3.638151 2.831957 1.354261
C -4.034319 -2.727411 1.329734
C -4.274351 3.604701 0.376970
C -4.829907 -3.344244 0.358613
C 5.113712 -1.653688 1.372688
C 5.647089 2.033667 -1.041639
H -0.551498 1.947945 -0.161535
H 0.174183 1.073327 -1.546165
H -0.031141 -1.492317 -1.594813
H -0.858083 -2.292271 -0.224295
H -2.143434 -0.057947 -1.876638
H 1.930792 1.779271 0.109346
H 1.077299 0.922687 1.424581
H 0.944383 -1.650749 1.354345
H 1.654428 -2.481518 -0.060514
H -3.580040 1.703583 -2.362899
H -3.917145 -1.495645 -2.352901
H -2.481538 1.047992 1.757964
H -2.570917 -1.186264 1.735627
H 3.503862 1.958201 -1.417807
H -4.747174 3.791046 -1.721249
H -5.402783 -3.373509 -1.722754
H -3.660256 3.147124 2.396288
H -4.070200 -3.072574 2.361833
H -4.790716 4.520712 0.656771
H -5.484847 -4.168671 0.633130
H 5.380175 -2.535078 1.980796
H 5.937511 2.907299 -1.615030


%chk=000213316-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213316

0 1
N -0.891267 -0.212601 0.011460
N 1.981135 -0.393790 0.319197
N 3.890206 -1.773357 0.407212
N 4.225941 1.904301 -0.382968
N 6.207349 -1.030148 0.110976
N 6.449755 1.375256 -0.408259
C -0.020679 0.962301 -0.244044
C -0.151668 -1.460958 -0.330879
C -2.213873 -0.141615 -0.688714
C 1.256725 0.855855 0.610639
C 1.131113 -1.591724 0.506305
C -2.906124 1.212038 -0.465262
C -3.136952 -1.285978 -0.234573
C 3.362272 -0.517154 0.232310
C 4.290958 0.536205 -0.057463
C -3.302495 1.996247 -1.575161
C -4.059428 -1.846658 -1.150594
C -3.188990 1.684806 0.842011
C -3.128199 -1.755902 1.102827
C 5.695975 0.225348 -0.093524
C -3.972654 3.227975 -1.389374
C -4.962984 -2.852791 -0.740407
C -3.850249 2.916748 1.031542
C -4.026214 -2.764423 1.514735
C -4.248161 3.692842 -0.083906
C -4.950375 -3.314834 0.595816
C 5.244466 -1.960501 0.331496
C 5.539243 2.342835 -0.577149
H -0.562393 1.882513 0.030781
H 0.265397 1.037268 -1.324528
H 0.116627 -1.479312 -1.416974
H -0.799283 -2.329969 -0.127968
H -2.066026 -0.250634 -1.794787
H 1.894523 1.735534 0.441266
H 0.962130 0.866422 1.682343
H 0.864986 -1.697954 1.579023
H 1.716704 -2.475623 0.212936
H -3.086910 1.642124 -2.591166
H -4.075336 -1.491739 -2.188994
H -2.888980 1.083898 1.707185
H -2.397235 -1.337094 1.803733
H 3.393204 2.475492 -0.507144
H -4.276358 3.821112 -2.259336
H -5.671160 -3.277420 -1.460887
H -4.063644 3.269913 2.046865
H -4.005594 -3.122165 2.550561
H -4.768137 4.645894 0.064141
H -5.648073 -4.096968 0.915392
H 5.584431 -2.990394 0.477669
H 5.769503 3.373478 -0.840560


