%chk=000271459.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271459

0 1
N 0.303421 0.107799 0.078783
N 1.386788 -0.725588 0.025814
N -2.909719 0.661930 1.231723
C -1.374103 -2.659812 -0.598895
C -1.295676 -1.761463 0.657741
C -2.564645 -2.263662 -1.478216
C -1.475505 -4.131522 -0.179509
C -0.898894 -0.350929 0.315739
C -1.982380 0.672665 0.230568
C -2.036316 1.591759 -0.837052
C 2.678110 -0.100048 0.058112
C -3.075735 2.523749 -0.867137
C -3.910258 1.577077 1.184527
C -4.031141 2.523284 0.153124
C 3.786451 -0.926870 0.336843
C 2.863453 1.260557 -0.253633
C 5.071080 -0.382815 0.288681
C 4.156138 1.780906 -0.290341
C 5.262759 0.966462 -0.021949
H -0.436901 -2.525225 -1.195689
H -0.589816 -2.189622 1.396920
H -2.276560 -1.767063 1.184927
H -2.490888 -1.218151 -1.800326
H -3.516757 -2.372462 -0.946836
H -2.618524 -2.882977 -2.379583
H -0.607637 -4.449959 0.405852
H -2.369548 -4.319349 0.426044
H -1.537029 -4.787226 -1.055647
H -1.269406 1.576140 -1.610780
H 1.328953 -1.660521 0.452896
H -3.139215 3.246910 -1.680280
H -4.630927 1.538539 2.009835
H -4.848915 3.238552 0.153345
H 3.653879 -1.977097 0.579233
H 2.001918 1.895535 -0.462098
H 5.930513 -1.018984 0.498538
H 4.304382 2.833526 -0.530975
H 6.266153 1.382357 -0.054501


%chk=000271459-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000271459

0 1
N 0.232261 0.256212 0.110791
N 1.308581 -0.578562 0.225764
N -3.358321 0.300520 0.547369
C -1.218865 -2.693785 -0.431830
C -1.284355 -1.659153 0.742837
C -2.275348 -2.380274 -1.516314
C -1.407562 -4.122622 0.129098
C -0.987792 -0.223694 0.345465
C -2.100280 0.751511 0.217779
C -1.879739 2.091327 -0.220944
C 2.622991 -0.104279 0.026922
C -2.970676 2.973136 -0.313575
C -4.402462 1.170703 0.451154
C -4.266688 2.511397 0.029695
C 3.702917 -1.017334 0.169614
C 2.882542 1.250002 -0.312873
C 5.027880 -0.576827 -0.026741
C 4.212991 1.673511 -0.506396
C 5.294428 0.770462 -0.366565
H -0.218024 -2.640299 -0.912773
H -0.586458 -1.982959 1.547227
H -2.302911 -1.682249 1.166367
H -2.112230 -1.384328 -1.965535
H -3.290970 -2.386738 -1.079676
H -2.237526 -3.132237 -2.326398
H -0.637001 -4.371798 0.883896
H -2.397883 -4.220544 0.613222
H -1.349728 -4.876547 -0.677611
H -0.863504 2.401303 -0.475485
H 1.184060 -1.564491 0.487687
H -2.819488 4.005056 -0.648840
H -5.384411 0.767038 0.725610
H -5.141658 3.166125 -0.029154
H 3.505246 -2.064673 0.433049
H 2.042373 1.940432 -0.416638
H 5.853247 -1.288738 0.086345
H 4.407578 2.719945 -0.768230
H 6.324287 1.109856 -0.518515


