%chk=000225429.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225429

0 1
N -2.404052 0.919463 1.555388
N 1.727190 0.481367 0.476512
N -0.616452 0.646473 0.020325
N -0.271138 1.703661 2.214412
N 0.829622 0.473110 -1.801508
C -5.623832 0.467332 -0.370892
C -5.401933 -0.855172 -0.942219
C -4.616055 1.082713 0.410611
C -4.170866 -1.511505 -0.710027
C -3.371628 0.353002 0.645761
C 5.282521 -0.631045 0.793339
C 5.924732 0.178095 -0.235254
C 3.884343 -0.541576 0.995017
C -3.160609 -0.880719 0.102773
C 5.135153 1.051015 -1.021688
C 3.102268 0.371652 0.158787
C -6.841366 1.168094 -0.591986
C 3.714041 1.127189 -0.806446
C -4.839638 2.386493 0.927895
C -6.383610 -1.508305 -1.735046
C -3.939712 -2.797120 -1.271812
C 6.032942 -1.521375 1.608256
C 7.322967 0.120482 -0.474616
C 3.270297 -1.337777 1.996507
C 5.755144 1.846625 -2.024630
C -7.043022 2.429824 -0.070225
C -6.028483 3.048966 0.694434
C -6.144507 -2.757710 -2.272369
C -4.910158 -3.408587 -2.039492
C 5.417208 -2.287738 2.578609
C 4.021519 -2.196708 2.775899
C 7.909513 0.898727 -1.453759
C 7.117203 1.770872 -2.235662
C -1.027105 1.054953 1.214120
C 0.732859 0.534161 -0.395607
H -2.220539 -1.413650 0.261794
H -7.622944 0.692507 -1.188109
H 3.145889 1.831091 -1.413242
H -4.059488 2.878812 1.508584
H -7.336541 -1.008638 -1.917631
H -2.986324 -3.290578 -1.087003
H 7.110908 -1.593314 1.458559
H 7.936143 -0.550752 0.129034
H -2.779337 1.656261 2.166847
H 2.191122 -1.260536 2.144378
H 5.139298 2.517675 -2.620592
H -7.978812 2.959289 -0.245132
H -6.193163 4.049497 1.091483
H -6.900895 -3.252657 -2.879056
H -4.737113 -4.393194 -2.471534
H 6.000706 -2.966877 3.198222
H 3.548574 -2.806069 3.542629
H 8.981470 0.849395 -1.631105
H 7.593629 2.379696 -3.002209
H 0.750467 1.645102 2.120754
H -0.575276 1.640720 3.176591
H 1.633138 0.003097 -2.197664
H -0.029163 0.339488 -2.324505


%chk=000225429-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225429

0 1
N -2.310486 0.921017 0.899979
N 1.840740 0.280666 0.403398
N -0.460989 -0.064771 -0.235390
N -0.129750 1.367811 1.648876
N 1.202721 -1.079990 -1.476197
C -5.915607 0.397243 -0.117099
C -5.767281 -0.560709 -1.216081
C -4.748644 0.902907 0.570146
C -4.439490 -0.978727 -1.585109
C -3.420095 0.424571 0.167547
C 5.525532 -0.162085 1.163045
C 6.128283 0.197139 -0.124548
C 4.090247 -0.167777 1.307503
C -3.290944 -0.478586 -0.878715
C 5.257285 0.547528 -1.219772
C 3.234729 0.196106 0.175019
C -7.201561 0.860391 0.300390
C 3.827941 0.538808 -1.040064
C -4.936866 1.857548 1.620659
C -6.872805 -1.097912 -1.943694
C -4.266730 -1.908272 -2.659386
C 6.314281 -0.519587 2.300583
C 7.538282 0.223317 -0.348594
C 3.508232 -0.535518 2.558746
C 5.825304 0.910989 -2.482514
C -7.357475 1.784959 1.339643
C -6.210477 2.293791 2.005365
C -6.682631 -2.008041 -2.993272
C -5.367296 -2.418041 -3.356353
C 5.724836 -0.871656 3.522244
C 4.307871 -0.883716 3.654256
C 8.075248 0.579289 -1.594445
C 7.211627 0.927730 -2.672502
C -0.936905 0.719866 0.743022
C 0.911353 -0.252177 -0.404769
H -2.287646 -0.806505 -1.156077
H -8.097124 0.486885 -0.203792
H 3.198666 0.858955 -1.879427
H -4.084436 2.296326 2.153827
H -7.895356 -0.802386 -1.690195
H -3.249637 -2.216677 -2.927257
H 7.405900 -0.522353 2.226114
H 8.225628 -0.038068 0.461884
H -2.552565 1.514506 1.692097
H 2.416691 -0.545754 2.634152
H 5.151441 1.181052 -3.304581
H -8.357926 2.118625 1.634406
H -6.319523 3.026753 2.811757
H -7.547877 -2.404510 -3.535607
H -5.222415 -3.128958 -4.177093
H 6.356866 -1.141110 4.375843
H 3.847547 -1.166707 4.607352
H 9.161149 0.590666 -1.738788
H 7.634010 1.208263 -3.643713
H 0.900285 1.167861 1.469902
H -0.484640 1.997389 2.366720
H 2.163228 -1.340225 -1.687671
H 0.426354 -1.492843 -1.985272


