%chk=000188657.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188657

0 1
N -2.976354 0.099808 0.231434
C -0.775701 1.161899 0.642442
C -2.202774 1.373781 0.083427
C -2.386052 -1.015299 -0.597662
C -0.133105 -0.021806 -0.048193
C -0.875566 -0.992879 -0.595271
C 0.035348 2.450915 0.493007
C -2.872790 -2.350135 -0.007869
C 1.346679 -0.090074 -0.060200
C -4.407303 0.329148 -0.131767
C 2.050821 0.071894 -1.263402
C 2.049480 -0.321199 1.133166
C 3.446673 0.004762 -1.269814
C 3.444606 -0.389865 1.118887
C 4.145487 -0.226014 -0.080723
H -0.857750 0.903649 1.731921
H -2.717031 2.161446 0.674106
H -2.151953 1.735616 -0.964950
H -2.720413 -0.945028 -1.669990
H -0.417105 -1.857393 -1.074885
H 0.199708 2.707990 -0.559600
H -0.466467 3.298597 0.970770
H 1.025583 2.353443 0.956342
H -3.962977 -2.439176 -0.055858
H -2.439105 -3.203845 -0.536003
H -2.591465 -2.427983 1.051416
H -4.971670 -0.605839 0.018343
H -4.574909 0.673364 -1.162712
H -4.835115 1.073667 0.558761
H 1.506780 0.251040 -2.188555
H 1.503715 -0.451496 2.065938
H 3.990704 0.131757 -2.204059
H 3.987516 -0.572487 2.044643
H 5.231803 -0.279158 -0.088390


%chk=000188657-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188657

0 1
N -2.948495 0.023728 0.307881
C -0.770078 1.219482 0.704919
C -2.260361 1.334278 0.313123
C -2.395500 -0.869291 -0.747317
C -0.108256 0.079442 -0.076457
C -0.877849 -0.816915 -0.758933
C -0.083111 2.589943 0.467522
C -2.855429 -2.335264 -0.547224
C 1.379481 -0.062979 -0.051584
C -4.414708 0.184735 0.219182
C 2.101762 -0.476060 -1.206565
C 2.118060 0.187275 1.139659
C 3.501664 -0.650890 -1.168569
C 3.518025 0.010754 1.180575
C 4.219111 -0.410043 0.026634
H -0.723480 0.981935 1.788782
H -2.774281 1.991871 1.039463
H -2.326860 1.837104 -0.689069
H -2.762421 -0.535871 -1.760410
H -0.394117 -1.636561 -1.307477
H -0.093348 2.848979 -0.607629
H -0.617134 3.387359 1.017972
H 0.967731 2.588219 0.800925
H -3.950353 -2.441613 -0.639577
H -2.392850 -2.987947 -1.309954
H -2.549890 -2.688057 0.453111
H -4.920844 -0.786863 0.343259
H -4.750990 0.630520 -0.752321
H -4.757971 0.845701 1.034733
H 1.559806 -0.637610 -2.145668
H 1.589366 0.495314 2.049247
H 4.034835 -0.964263 -2.073635
H 4.061390 0.199037 2.113718
H 5.306395 -0.542349 0.056382


