%chk=000206827.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206827

0 1
N -2.264349 -1.184425 0.576915
N 0.460910 -1.814269 -0.928027
C -1.714795 0.063140 0.203820
C -3.763058 -1.046967 0.662579
C -4.042747 0.477649 0.660959
C -2.710395 1.093582 0.337152
C -1.728313 -2.464546 0.060057
C -0.401344 0.387921 -0.155671
C -0.887193 -2.317729 -1.226576
C 0.638051 -0.630321 -0.427860
C -2.385210 2.418522 0.169668
C -0.093057 1.763920 -0.313288
C -1.049287 2.753122 -0.154524
C 2.048814 -0.247178 -0.114521
C 2.368087 0.221286 1.169548
C 3.050514 -0.367498 -1.088083
C 3.685253 0.573643 1.472029
C 4.365890 -0.008161 -0.779239
C 4.684127 0.462650 0.498203
H -4.091019 -1.524346 1.607955
H -4.279428 -1.553864 -0.174972
H -4.410672 0.819253 1.646132
H -4.812819 0.753548 -0.080124
H -2.550520 -3.192672 -0.105161
H -1.087506 -2.892251 0.872158
H -0.745061 -3.319828 -1.695890
H -1.416850 -1.687799 -1.975428
H -3.131591 3.202598 0.274721
H 0.930491 2.040881 -0.577414
H -0.782602 3.798858 -0.285341
H 1.587824 0.306757 1.925787
H 2.801481 -0.753199 -2.076906
H 3.934554 0.933929 2.468385
H 5.143635 -0.101189 -1.535027
H 5.709085 0.739583 0.736783


%chk=000206827-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206827

0 1
N -2.318090 -1.213807 0.370175
N 0.505540 -1.778784 -0.975817
C -1.767342 0.055098 0.164619
C -3.784272 -1.111643 0.616969
C -4.019941 0.389744 0.952792
C -2.746657 1.061583 0.453834
C -1.768890 -2.471762 -0.157581
C -0.436173 0.421752 -0.220942
C -0.836482 -2.232087 -1.378247
C 0.656360 -0.565469 -0.470727
C -2.456857 2.417453 0.302890
C -0.177984 1.824554 -0.363302
C -1.155321 2.805254 -0.130361
C 2.070531 -0.186963 -0.120876
C 2.371742 0.645951 0.990409
C 3.143529 -0.727189 -0.879235
C 3.712293 0.934279 1.330411
C 4.481485 -0.431490 -0.546154
C 4.772318 0.401944 0.560964
H -4.090748 -1.784201 1.438041
H -4.339241 -1.417307 -0.297960
H -4.127099 0.531124 2.045379
H -4.934727 0.784227 0.477893
H -2.620688 -3.114140 -0.459908
H -1.198005 -3.019989 0.616439
H -0.716869 -3.189480 -1.916187
H -1.339777 -1.510956 -2.060346
H -3.220439 3.175589 0.513601
H 0.822887 2.131181 -0.684258
H -0.916143 3.863349 -0.276713
H 1.556911 1.052465 1.598767
H 2.900289 -1.386678 -1.718019
H 3.928591 1.569340 2.197089
H 5.298020 -0.849231 -1.146201
H 5.812148 0.630886 0.821363


