%chk=000203087.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203087

0 1
N 0.668124 1.784144 0.292075
C 2.154843 1.724806 0.079595
C 2.555999 0.250430 -0.176894
C -0.114776 1.504228 -0.957679
C 2.691059 2.641367 -1.029598
C 4.022042 0.032995 0.068818
C 0.264646 3.083971 0.906619
C -1.587838 1.435787 -0.658738
C -2.260356 0.312530 -0.361682
C 4.919152 -0.053904 -1.007013
C 4.505690 -0.087281 1.382035
C -3.723829 0.345667 -0.114594
C -1.632989 -1.025134 -0.247534
C 6.281135 -0.259918 -0.770657
C 5.867876 -0.291967 1.612474
C 6.759185 -0.378921 0.537778
C -4.243195 -0.166822 1.085337
C -2.049515 -2.070431 -1.087149
C -4.593312 0.887541 -1.074114
C -0.632916 -1.254562 0.710223
C -5.618790 -0.128409 1.323365
C -1.462443 -3.332871 -0.971446
C -5.969275 0.919192 -0.831082
C -0.053961 -2.520841 0.823731
C -6.483908 0.414088 0.366843
C -0.466075 -3.560506 -0.016290
H 2.618073 2.042945 1.054312
H 2.276068 -0.053056 -1.204488
H 1.955404 -0.411820 0.486456
H 0.241230 0.527713 -1.364283
H 0.060831 2.260752 -1.755964
H 3.787016 2.596018 -1.068856
H 2.413207 3.685968 -0.859459
H 2.324801 2.356022 -2.020202
H 0.888976 3.285486 1.791022
H -0.775356 2.993636 1.263867
H 0.326449 3.951248 0.233881
H -2.106403 2.395224 -0.705773
H 4.554833 0.037845 -2.027785
H 3.816373 -0.022235 2.221598
H 6.971591 -0.328483 -1.609506
H 6.236734 -0.385318 2.632496
H 7.818999 -0.539653 0.719550
H -3.568788 -0.594707 1.826646
H -2.831519 -1.895043 -1.824031
H -4.195792 1.277835 -2.008844
H -0.305933 -0.432500 1.352989
H -6.018457 -0.523841 2.255701
H -1.784152 -4.141687 -1.624717
H -6.641422 1.338249 -1.577737
H 0.719955 -2.698142 1.568393
H -7.555090 0.441033 0.554473
H -0.012903 -4.545368 0.073537


%chk=000203087-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000203087

0 1
N 0.747188 1.619918 0.415267
C 2.227935 1.674918 0.173529
C 2.772563 0.271390 -0.235650
C -0.063532 1.288682 -0.800393
C 2.696717 2.772222 -0.822302
C 4.282022 0.154171 -0.079067
C 0.244537 2.810245 1.136911
C -1.560320 1.261279 -0.560399
C -2.348170 0.164780 -0.302215
C 5.142694 0.139490 -1.206278
C 4.865708 0.064571 1.213036
C -3.837979 0.336101 -0.245862
C -1.793529 -1.205444 -0.067488
C 6.544961 0.041685 -1.051567
C 6.265240 -0.033308 1.374147
C 7.112052 -0.043925 0.240471
C -4.616872 -0.369938 0.713405
C -2.438254 -2.348987 -0.619170
C -4.510851 1.223651 -1.132018
C -0.624197 -1.401775 0.719708
C -6.012321 -0.177507 0.799508
C -1.921999 -3.644776 -0.406780
C -5.906850 1.415640 -1.048160
C -0.112800 -2.700409 0.936021
C -6.665354 0.718229 -0.079184
C -0.756370 -3.827573 0.374670
H 2.666930 1.909034 1.165483
H 2.492943 0.053152 -1.283729
H 2.264200 -0.474757 0.403658
H 0.273099 0.304001 -1.169778
H 0.117154 2.034934 -1.614291
H 3.800026 2.805320 -0.853970
H 2.336127 3.772441 -0.521562
H 2.337905 2.568791 -1.848623
H 0.870224 2.983209 2.031020
H -0.790190 2.624263 1.473558
H 0.240947 3.749750 0.530809
H -2.068786 2.231721 -0.643870
H 4.709475 0.200791 -2.212448
H 4.215389 0.060979 2.097433
H 7.192183 0.029255 -1.936123
H 6.695783 -0.107032 2.379550
H 8.198160 -0.122559 0.363268
H -4.119447 -1.061810 1.401883
H -3.342777 -2.216591 -1.223503
H -3.936262 1.741946 -1.908274
H -0.127593 -0.525529 1.156592
H -6.589791 -0.724204 1.553665
H -2.428157 -4.510886 -0.848181
H -6.404665 2.098100 -1.746567
H 0.785108 -2.833481 1.550972
H -7.749624 0.863619 -0.016152
H -0.359284 -4.834485 0.546739


