%chk=000181757.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181757

0 1
N 1.258306 1.174823 0.129408
C -2.404861 0.219727 -0.564659
C -1.198834 0.931906 0.081835
C 0.131582 0.397929 -0.473660
C 2.605065 0.675112 -0.315680
C -2.458193 -1.237596 -0.144149
C -3.726713 0.898297 -0.255714
C 3.669450 1.219412 0.671310
C 2.871015 1.172076 -1.741629
C 5.015399 0.595423 0.431512
C -2.123365 -2.237692 -1.069984
C -4.773147 0.778424 -1.186639
C -2.824606 -1.600918 1.160517
C -3.940710 1.624605 0.923903
C 5.275736 -0.710887 0.876505
C 6.022312 1.311891 -0.233576
C -2.153121 -3.583215 -0.692619
C -6.008211 1.381678 -0.941738
C -2.853431 -2.947002 1.533158
C -5.178745 2.229400 1.164439
C -2.516639 -3.941369 0.608932
C -6.214447 2.111175 0.234190
C 6.527946 -1.289938 0.657403
C 7.273490 0.727822 -0.449087
C 7.529731 -0.573065 -0.005147
H -2.257390 0.270609 -1.678698
H -1.228248 0.814258 1.181712
H -1.264714 2.023382 -0.111099
H 0.168344 0.544288 -1.576203
H 0.210429 -0.697240 -0.292741
H 2.652937 -0.446658 -0.308984
H 1.188648 1.138770 1.152321
H 3.355079 1.034447 1.718624
H 3.719102 2.324807 0.580475
H 3.902159 0.962240 -2.047113
H 2.708353 2.255053 -1.818515
H 2.202944 0.696174 -2.466327
H -1.840948 -1.970744 -2.086106
H -4.624914 0.207133 -2.101324
H -3.097885 -0.832369 1.881939
H -3.146907 1.725866 1.661383
H 4.502110 -1.274010 1.393543
H 5.829401 2.324196 -0.583243
H -1.893457 -4.354096 -1.416169
H -6.813155 1.283130 -1.668243
H -3.141857 -3.222187 2.546318
H -5.334026 2.794417 2.082076
H -2.540303 -4.988720 0.900957
H -7.176265 2.582378 0.422889
H 6.724447 -2.302930 1.004631
H 8.051066 1.289040 -0.964691
H 8.504043 -1.025552 -0.173640


%chk=000181757-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000181757

0 1
N 1.277051 1.019072 0.093256
C -2.460525 0.239079 -0.591643
C -1.195106 0.904910 0.020259
C 0.123078 0.359147 -0.561500
C 2.624476 0.538144 -0.313299
C -2.538784 -1.253148 -0.225040
C -3.768682 0.965295 -0.230224
C 3.662805 1.162560 0.665947
C 2.924880 0.921305 -1.776948
C 5.077423 0.637698 0.477615
C -2.231440 -2.254505 -1.179836
C -4.951152 0.637034 -0.946099
C -2.898605 -1.657824 1.087030
C -3.857328 1.938871 0.796105
C 5.413246 -0.686235 0.867449
C 6.090583 1.444729 -0.100142
C -2.275086 -3.625634 -0.836072
C -6.180755 1.262564 -0.652825
C -2.939338 -3.024973 1.436490
C -5.089274 2.566933 1.097027
C -2.626688 -4.016217 0.475857
C -6.255695 2.233497 0.374479
C 6.719740 -1.189882 0.683109
C 7.400867 0.946334 -0.286569
C 7.720300 -0.374347 0.103492
H -2.351646 0.296747 -1.695434
H -1.196397 0.753371 1.120402
H -1.223151 1.996479 -0.158100
H 0.154655 0.583257 -1.645390
H 0.152240 -0.753388 -0.458878
H 2.701461 -0.576854 -0.224911
H 1.175741 0.968092 1.119099
H 3.325203 0.946334 1.702006
H 3.630569 2.260721 0.538619
H 3.955520 0.632708 -2.047582
H 2.810292 2.012840 -1.908762
H 2.239371 0.414345 -2.479079
H -1.956672 -1.959288 -2.200666
H -4.903425 -0.123113 -1.736112
H -3.167270 -0.897906 1.831012
H -2.965440 2.221791 1.364784
H 4.645799 -1.323036 1.326110
H 5.850417 2.471328 -0.403260
H -2.036183 -4.385154 -1.589390
H -7.078779 0.995101 -1.221509
H -3.222594 -3.319334 2.453722
H -5.134883 3.318218 1.894002
H -2.662886 -5.077779 0.745326
H -7.208978 2.721910 0.605742
H 6.959689 -2.213353 0.993782
H 8.169955 1.587410 -0.732683
H 8.735402 -0.762154 -0.038166


