%chk=000187127.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187127

0 1
N 1.252877 0.445870 -0.000105
C -0.620819 -1.848359 0.000248
C -1.082241 -0.402557 -0.000001
C -0.171377 0.673875 -0.000134
C -1.106956 -2.561534 -1.267721
C -1.106493 -2.560877 1.268766
C -2.454085 -0.099611 -0.000058
C -0.617752 2.007142 -0.000297
C -2.903208 1.221519 -0.000223
C -1.985362 2.277841 -0.000335
C 2.054822 0.312901 1.143466
C 2.054340 0.309473 -1.143612
C 3.363119 0.097669 0.712999
C 3.362818 0.095525 -0.713054
H 0.501461 -1.886263 0.000050
H -2.198892 -2.630221 -1.311750
H -0.713226 -3.583143 -1.317369
H -0.773103 -2.036040 -2.170020
H -0.772173 -2.034995 2.170669
H -0.712868 -3.582510 1.318732
H -2.198419 -2.629395 1.313306
H -3.178741 -0.914443 0.000043
H 0.107675 2.821842 -0.000401
H -3.972213 1.431251 -0.000260
H -2.336393 3.308502 -0.000464
H 1.657154 0.380779 2.137055
H 1.656257 0.374405 -2.137231
H 4.222181 -0.041119 1.336673
H 4.221617 -0.045129 -1.336672


%chk=000187127-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000187127

0 1
N 1.256272 0.457484 -0.000164
C -0.618184 -1.850414 0.000458
C -1.086827 -0.392491 0.000154
C -0.170822 0.696792 -0.000045
C -1.089128 -2.594042 -1.278057
C -1.089894 -2.593728 1.278876
C -2.472185 -0.078718 0.000121
C -0.622485 2.037924 -0.000120
C -2.931024 1.255025 0.000037
C -2.003529 2.323172 -0.000039
C 2.057859 0.317385 1.140624
C 2.056935 0.312812 -1.141030
C 3.373555 0.082584 0.719999
C 3.372979 0.079743 -0.720525
H 0.487110 -1.853564 0.000789
H -2.192779 -2.645314 -1.332172
H -0.702391 -3.629905 -1.282211
H -0.727211 -2.088026 -2.191297
H -0.728569 -2.087450 2.192203
H -0.703097 -3.629566 1.283542
H -2.193574 -2.645059 1.332316
H -3.202379 -0.896493 0.000220
H 0.120728 2.842366 -0.000302
H -4.006945 1.462811 0.000039
H -2.351364 3.361687 -0.000105
H 1.627349 0.400420 2.136373
H 1.625653 0.391967 -2.136762
H 4.232519 -0.064818 1.373266
H 4.231432 -0.070186 -1.373889


