%chk=000194314.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194314

1 1
O 1.483483 0.705100 0.611730
N 4.465789 0.821778 -0.038994
N 0.116722 -1.097205 0.028963
C 3.734516 0.507108 1.270836
C 4.730647 -0.445702 -0.819517
C 3.645442 1.772192 -0.881087
C 5.790266 1.476426 0.296633
C 2.440740 -0.286334 1.094510
C 0.261305 0.219991 0.167960
C -1.238862 -3.054778 -0.566762
C -1.112282 -1.564284 -0.446552
C -0.720956 1.220950 -0.131071
C -2.173069 -3.616135 0.517667
C -1.957548 0.721229 -0.629787
C -2.127534 -0.688697 -0.781337
C -2.329074 -5.137051 0.383910
C -0.532900 2.621433 0.053912
C -2.987327 1.658487 -0.955954
C -3.256235 -5.698985 1.457789
C -1.543036 3.494208 -0.264814
C -2.781412 3.004333 -0.777781
H 4.419390 -0.054629 1.951081
H 3.493056 1.473040 1.787573
H 5.311292 -0.246899 -1.740535
H 5.299088 -1.185218 -0.225681
H 3.785199 -0.933617 -1.137818
H 4.096804 1.943929 -1.873568
H 2.611288 1.381413 -1.039553
H 3.521742 2.754890 -0.389569
H 6.450718 0.803329 0.875013
H 6.345529 1.766348 -0.616828
H 5.653749 2.398689 0.893293
H 2.509200 -1.132473 0.383229
H 2.064285 -0.669745 2.066770
H -1.622420 -3.318484 -1.575689
H -0.243150 -3.543064 -0.490081
H -3.166590 -3.130063 0.455215
H -1.777029 -3.364337 1.521248
H -3.078915 -1.065802 -1.157868
H -2.724997 -5.391754 -0.619410
H -1.338714 -5.628775 0.452074
H 0.415304 2.969756 0.459952
H -3.935539 1.281843 -1.342587
H -4.262529 -5.267999 1.394905
H -2.878840 -5.503121 2.468014
H -3.364629 -6.786136 1.357302
H -1.423195 4.568880 -0.127263
H -3.566074 3.724535 -1.022471


%chk=000194314-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000194314

1 1
O 1.345395 0.558298 0.293930
N 4.370012 0.764596 0.199039
N -0.221587 -1.113275 -0.239979
C 3.506880 0.013139 1.254275
C 4.357033 0.042074 -1.145551
C 3.848915 2.194178 0.007175
C 5.805278 0.827732 0.722263
C 2.182699 -0.557990 0.756605
C 0.052552 0.181966 -0.168470
C -1.727223 -3.004714 -0.730962
C -1.471699 -1.514856 -0.716618
C -0.834284 1.252943 -0.529240
C -1.915639 -3.594151 0.695168
C -2.123327 0.837626 -1.039216
C -2.412504 -0.566723 -1.124150
C -2.108957 -5.127464 0.679937
C -0.523310 2.642584 -0.409278
C -3.059113 1.848701 -1.431436
C -2.298362 -5.716389 2.094106
C -1.460707 3.604109 -0.798039
C -2.732826 3.202503 -1.315508
H 4.128099 -0.820707 1.626392
H 3.344547 0.731170 2.075701
H 5.079707 0.536024 -1.813337
H 4.645554 -1.009995 -0.998666
H 3.348567 0.104330 -1.578175
H 4.434013 2.675972 -0.791578
H 2.784184 2.136835 -0.255552
H 3.977176 2.745361 0.951643
H 6.231488 -0.187090 0.739565
H 6.401844 1.472369 0.058860
H 5.797839 1.248161 1.739617
H 2.299642 -1.310881 -0.042893
H 1.693744 -1.077473 1.602959
H -2.624256 -3.222394 -1.339462
H -0.869317 -3.514484 -1.211786
H -2.790964 -3.114862 1.177914
H -1.031071 -3.335566 1.310884
H -3.383641 -0.896868 -1.505266
H -2.987486 -5.380659 0.052825
H -1.232306 -5.601729 0.193052
H 0.442740 2.945385 0.006534
H -4.037599 1.545850 -1.819979
H -3.189550 -5.286742 2.588339
H -1.422592 -5.502985 2.735766
H -2.430267 -6.812706 2.058100
H -1.230043 4.670186 -0.702638
H -3.456580 3.967211 -1.615869


