%chk=000240852.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240852

0 1
N 2.396273 1.482680 -0.333571
N -3.413772 1.473952 0.378941
N 1.185436 1.623387 0.326853
N -2.205443 1.559728 -0.295731
N 0.112554 2.495353 -1.701372
N -1.148762 2.681683 1.614863
C 6.876523 -0.345564 -0.309990
C -5.898418 -1.536443 0.217006
C 7.616705 -1.563006 0.259625
C -6.697556 -2.743310 -0.290607
C 5.501069 -0.171121 0.347066
C -6.561141 -0.213175 -0.188221
C 8.993245 -1.740899 -0.396470
C -6.031020 -4.066228 0.112888
C 4.762826 1.046972 -0.224047
C -5.775480 1.002447 0.320452
C 9.734632 -2.951209 0.166826
C -6.820763 -5.273119 -0.388708
C 3.419160 1.220433 0.430440
C -4.435240 1.126056 -0.352495
C 0.146106 2.018483 -0.389941
C -1.173393 2.052328 0.368495
H 7.484651 0.567746 -0.162181
H 6.759411 -0.455899 -1.405730
H -5.797101 -1.584545 1.318641
H -4.862909 -1.574343 -0.175839
H 7.735034 -1.456202 1.355053
H 7.010487 -2.477546 0.111474
H -7.730279 -2.708472 0.106090
H -6.796926 -2.695866 -1.392047
H 5.617696 -0.067525 1.443365
H 4.890043 -1.082763 0.191974
H -6.668447 -0.165131 -1.289404
H -7.592396 -0.171363 0.215064
H 9.602178 -0.827665 -0.248092
H 8.876395 -1.851564 -1.492416
H -5.930850 -4.116606 1.214848
H -4.997910 -4.103587 -0.285447
H 5.357332 1.972163 -0.065462
H 4.660972 0.948833 -1.326691
H -6.351945 1.933601 0.130790
H -5.663412 0.948643 1.425319
H 9.175798 -3.879594 0.002410
H 9.901528 -2.856664 1.245833
H 10.715229 -3.070753 -0.307340
H -6.904895 -5.274766 -1.481361
H -6.336824 -6.211679 -0.096025
H -7.838079 -5.287807 0.018314
H 3.403244 1.119488 1.525413
H -4.421149 0.916009 -1.431931
H 0.917799 2.297015 -2.285298
H -0.774354 2.479111 -2.191903
H -1.950161 2.536477 2.219500
H -0.261896 2.734926 2.103077


%chk=000240852-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240852

0 1
N 2.492091 1.215862 -0.271023
N -3.414598 1.240788 0.332641
N 1.281073 1.276392 0.496952
N -2.200142 1.208965 -0.432338
N 0.205814 1.134931 -1.663405
N -1.127570 1.356950 1.729345
C 7.179550 -0.073206 -0.275872
C -6.231976 -1.327155 0.187377
C 8.008293 -1.279137 0.220235
C -7.118794 -2.498488 -0.290577
C 5.765981 -0.011853 0.345371
C -6.754361 0.051818 -0.273690
C 9.417404 -1.351935 -0.411949
C -6.603286 -3.881511 0.169552
C 4.943319 1.202234 -0.168749
C -5.870654 1.238749 0.203867
C 10.239158 -2.560676 0.085550
C -7.491150 -5.047909 -0.315567
C 3.577937 1.278002 0.460503
C -4.494842 1.218660 -0.409041
C 0.208421 1.225036 -0.301132
C -1.129092 1.266188 0.367152
H 7.723954 0.866824 -0.045755
H 7.090652 -0.118565 -1.381312
H -6.167213 -1.340487 1.295388
H -5.196668 -1.472757 -0.182248
H 8.106126 -1.230356 1.325048
H 7.459758 -2.218429 -0.001520
H -8.155326 -2.353063 0.080639
H -7.181899 -2.483541 -1.399211
H 5.850383 0.037709 1.450588
H 5.216108 -0.945414 0.113095
H -6.824980 0.068219 -1.381352
H -7.784528 0.202339 0.107205
H 9.965550 -0.413515 -0.189344
H 9.318318 -1.399145 -1.515726
H -6.541749 -3.896541 1.276928
H -5.567421 -4.024531 -0.200113
H 5.507497 2.130680 0.062834
H 4.830840 1.148829 -1.267400
H -6.372367 2.188598 -0.078576
H -5.774768 1.231113 1.305487
H 9.728355 -3.512534 -0.153698
H 10.377164 -2.521780 1.182719
H 11.241534 -2.588834 -0.380082
H -7.542229 -5.073551 -1.420664
H -7.101542 -6.024229 0.027094
H -8.525131 -4.944095 0.064640
H 3.511119 1.366735 1.561925
H -4.418311 1.178503 -1.513092
H 1.106356 1.100493 -2.139041
H -0.699268 1.102310 -2.134666
H -2.028085 1.380411 2.205662
H -0.222998 1.388999 2.201645


