%chk=000201066.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201066

0 1
O 5.127967 1.592454 0.210641
N -3.389788 -0.656298 0.145652
N -1.863332 1.019053 -0.177327
N 4.484752 -0.602695 -0.104226
C -1.198172 -0.198471 -0.001019
C 0.259440 -0.288846 -0.030879
C -3.194312 0.751624 -0.091078
C -2.120079 -1.245166 0.201418
C 0.895516 -1.530914 -0.202021
C 1.046303 0.870703 0.109091
C -4.663078 -1.210965 0.277763
C 3.062485 -0.451483 -0.075383
C -4.349308 1.585380 -0.191408
C 2.285318 -1.620793 -0.224090
C 2.436419 0.796351 0.090202
C -5.749106 -0.379441 0.176102
C -5.590513 1.025826 -0.060009
C 5.439291 0.432899 0.039276
C 6.862477 -0.048216 -0.040848
H -1.952569 -2.286665 0.377225
H 0.301230 -2.435908 -0.325341
H 0.555517 1.842105 0.231026
H -4.734796 -2.285183 0.456734
H -4.190226 2.649768 -0.371619
H 2.757222 -2.590121 -0.357861
H 3.035178 1.707621 0.202741
H -6.756903 -0.781065 0.274689
H -6.489464 1.638691 -0.132188
H 4.822131 -1.556920 -0.243700
H 7.098458 -0.508334 -1.009229
H 7.549480 0.807446 0.080188
H 7.110663 -0.767337 0.750477


%chk=000201066-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000201066

0 1
O 5.233096 1.693153 -0.066231
N -3.425116 -0.679776 0.042215
N -1.881572 1.024732 0.022099
N 4.511040 -0.543313 -0.045126
C -1.227524 -0.214810 0.018319
C 0.240316 -0.302663 0.002617
C -3.209296 0.747563 0.036377
C -2.163224 -1.273262 0.030650
C 0.920169 -1.550713 0.001358
C 1.020505 0.884575 -0.012091
C -4.701748 -1.227587 0.056339
C 3.093696 -0.408497 -0.029531
C -4.346464 1.601262 0.045799
C 2.323571 -1.604553 -0.014559
C 2.426989 0.847349 -0.027979
C -5.802244 -0.380691 0.065357
C -5.628162 1.045243 0.060112
C 5.491246 0.455082 -0.062921
C 6.920356 -0.092419 -0.076928
H -2.039035 -2.352093 0.031804
H 0.354035 -2.488986 0.013258
H 0.493850 1.843823 -0.010673
H -4.777476 -2.317386 0.059696
H -4.176418 2.680526 0.041381
H 2.828814 -2.579698 -0.015156
H 3.016397 1.765413 -0.039321
H -6.803686 -0.818645 0.076499
H -6.508217 1.695319 0.067414
H 4.855187 -1.506915 -0.043331
H 7.106822 -0.708489 -0.976402
H 7.618964 0.756310 -0.080655
H 7.123331 -0.714753 0.814609


