%chk=000183293.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183293

0 1
O 0.629614 4.362167 -2.650602
N -4.364849 -1.687086 0.460782
N 2.840557 0.666537 0.830671
N -0.613803 -0.944619 -1.991464
N 0.312284 -2.448691 -0.386708
C -4.508573 -2.397797 1.775991
C -4.715749 -0.257025 0.755135
C -4.291174 -1.369745 2.909102
C -4.434222 0.014661 2.250774
C -2.984238 -1.832066 -0.105472
C -3.037830 -1.531354 -1.612684
C -1.718191 -1.882478 -2.313427
C 1.141684 -0.165334 -0.480267
C 2.106204 -0.486237 0.541045
C 1.317954 1.220861 -0.829807
C 0.261717 -1.189323 -0.930765
C 2.381293 1.726605 -0.004320
C 2.172619 -1.796283 1.080806
C 0.686063 2.068933 -1.748661
C 2.809478 3.059123 -0.086137
C 3.949443 0.789780 1.782732
C 1.251452 -2.713396 0.568991
C 1.131801 3.388698 -1.810883
C 3.153250 -2.203817 2.125861
C 2.178337 3.894284 -0.994604
C -0.418837 3.984652 -3.573286
H -3.824883 -3.261194 1.858935
H -5.543446 -2.800653 1.804587
H -5.798215 -0.144844 0.533685
H -4.176061 0.446397 0.097506
H -3.294040 -1.488404 3.363994
H -5.023708 -1.510402 3.719108
H -5.249015 0.597322 2.708172
H -3.514483 0.608638 2.378721
H -2.233410 -1.185518 0.395264
H -2.635108 -2.878218 0.047885
H -3.308210 -0.473543 -1.784575
H -3.862058 -2.119723 -2.069173
H -1.853239 -1.853054 -3.418849
H -1.408610 -2.926415 -2.061664
H -0.817229 0.038346 -2.183524
H -0.105853 1.693696 -2.385464
H 3.615051 3.429674 0.543156
H 4.832146 0.220538 1.437599
H 4.249764 1.845460 1.900599
H 3.653443 0.411292 2.778441
H 1.232357 -3.748509 0.935958
H 3.033833 -3.258299 2.412606
H 4.186808 -2.089810 1.771139
H 3.034060 -1.612015 3.043562
H 2.467475 4.937367 -1.104003
H -0.595501 4.926502 -4.109297
H -1.312286 3.672861 -3.025591
H -0.063967 3.207256 -4.256181


%chk=000183293-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000183293

0 1
O 0.743872 4.441316 -2.732814
N -4.594007 -1.755951 0.435024
N 2.954565 0.709017 0.813004
N -0.745573 -0.868440 -1.739397
N 0.330786 -2.394022 -0.301589
C -4.824990 -2.420683 1.750311
C -4.918977 -0.326440 0.723404
C -4.276148 -1.443566 2.843512
C -4.440795 -0.029769 2.194504
C -3.211920 -1.952391 -0.097690
C -3.145038 -1.669938 -1.611595
C -1.726334 -1.864141 -2.202220
C 1.193646 -0.118746 -0.423340
C 2.182454 -0.444415 0.573154
C 1.393604 1.268877 -0.809901
C 0.259980 -1.132063 -0.818650
C 2.491270 1.748259 -0.020497
C 2.262534 -1.759400 1.126461
C 0.778005 2.148392 -1.742486
C 2.972824 3.070185 -0.130128
C 4.079550 0.905675 1.730249
C 1.304027 -2.664246 0.618120
C 1.262694 3.472197 -1.849058
C 3.256909 -2.242063 2.166428
C 2.347096 3.931156 -1.048896
C -0.366884 4.042506 -3.594193
H -4.352904 -3.417479 1.770132
H -5.916209 -2.556930 1.885935
H -6.014946 -0.190430 0.650225
H -4.448441 0.337763 -0.021621
H -3.211444 -1.656954 3.047432
H -4.825710 -1.537110 3.796912
H -5.184224 0.584749 2.732955
H -3.485840 0.524367 2.203945
H -2.451954 -1.330691 0.431815
H -2.928002 -3.006862 0.075475
H -3.500927 -0.640299 -1.823395
H -3.846756 -2.354524 -2.126464
H -1.780460 -1.822079 -3.308410
H -1.328480 -2.851840 -1.915277
H -0.863951 0.093942 -2.047500
H -0.039935 1.818065 -2.388266
H 3.813141 3.429308 0.472112
H 5.018211 1.088108 1.172321
H 3.888559 1.776255 2.385348
H 4.216895 0.023708 2.364928
H 1.313371 -3.698411 0.987277
H 3.094615 -3.317259 2.359804
H 4.307953 -2.128428 1.837449
H 3.146411 -1.721371 3.137916
H 2.679496 4.965431 -1.176595
H -0.608971 4.937100 -4.186853
H -1.253266 3.740738 -3.000498
H -0.077485 3.215622 -4.273419


