%chk=000297757.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000297757

0 1
N -1.623817 -0.008280 -0.323979
N -3.800340 0.706579 0.259210
C 0.406890 -1.329842 -0.117546
C 0.555748 1.131481 -0.024132
C 1.828624 -1.408446 0.021414
C 1.976809 1.022829 0.117115
C -0.216817 -0.054583 -0.120600
C 2.588894 -0.236735 0.145099
C -0.341841 -2.555780 -0.251481
C -0.027831 2.450041 -0.081704
C 2.455351 -2.710855 0.039184
C 2.761075 2.232616 0.236375
C 0.284291 -3.767490 -0.232830
C 0.743974 3.568648 0.028927
C 1.710055 -3.845640 -0.081192
C 2.166172 3.457335 0.198554
C -2.444682 0.450513 0.585453
C -4.293918 0.217925 -1.054394
C -4.759186 0.472229 1.372262
H 3.668458 -0.307614 0.260178
H -1.422934 -2.484771 -0.383563
H -1.104025 2.536382 -0.237647
H 3.537359 -2.753769 0.148530
H 3.838534 2.130300 0.353368
H -0.275274 -4.694028 -0.337273
H 0.306186 4.563400 -0.016905
H 2.174012 -4.830698 -0.069363
H 2.748132 4.373250 0.288041
H -2.170657 0.755045 1.614032
H -5.276681 0.665108 -1.266268
H -4.370852 -0.878896 -1.116099
H -3.593704 0.541303 -1.849949
H -5.722047 0.950472 1.120255
H -4.397501 0.946326 2.299349
H -4.948457 -0.594156 1.574680


%chk=000297757-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000297757

0 1
N -1.630396 -0.174844 -0.318341
N -3.825556 0.436514 0.316005
C 0.467477 -1.406142 -0.192080
C 0.506751 1.074880 0.008313
C 1.912595 -1.438896 -0.016869
C 1.955962 1.017081 0.188564
C -0.231934 -0.151685 -0.145432
C 2.622991 -0.230633 0.184844
C -0.232935 -2.645837 -0.394921
C -0.117480 2.373555 -0.046916
C 2.582581 -2.715385 -0.040746
C 2.683612 2.250036 0.366677
C 0.448067 -3.861120 -0.417698
C 0.621244 3.543353 0.113917
C 1.873130 -3.896793 -0.234034
C 2.038936 3.481478 0.340207
C -2.464779 0.368878 0.533888
C -4.418411 -0.078422 -0.925530
C -4.735247 0.967048 1.336148
H 3.709451 -0.260476 0.333373
H -1.316432 -2.602362 -0.542223
H -1.190776 2.439102 -0.250835
H 3.670784 -2.736251 0.095029
H 3.769026 2.194814 0.514538
H -0.098640 -4.796536 -0.581869
H 0.125280 4.518642 0.053910
H 2.397201 -4.859193 -0.251654
H 2.607836 4.408503 0.472960
H -2.148248 0.795248 1.503984
H -4.988081 0.716401 -1.444633
H -5.104513 -0.922032 -0.714175
H -3.601283 -0.428958 -1.574750
H -5.334714 1.806188 0.932012
H -4.158881 1.338411 2.200333
H -5.434620 0.185632 1.695103


