%chk=000216746.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216746

0 1
N 0.325921 -1.356591 -0.972006
N 2.955368 -0.218062 -0.506844
N 7.213759 1.399733 1.149655
C 0.532074 -0.266887 0.038314
C 1.312989 -1.191770 -2.090876
C 1.960284 -0.363532 0.607275
C 2.742518 -1.301842 -1.522124
C -1.077303 -1.331025 -1.510215
C 4.358908 -0.234839 0.014596
C -2.055551 -1.720977 -0.425807
C -3.167607 -0.925060 -0.090565
C 4.728356 1.218587 0.384640
C -1.848825 -2.935724 0.249310
C -3.446524 0.392959 -0.767727
C -4.054610 -1.365531 0.906209
C -2.733623 -3.363229 1.239512
C -2.503490 1.482232 -0.325925
C -3.842424 -2.576359 1.566623
C 6.111758 1.317798 0.810500
C -2.242638 1.685174 1.038646
C -1.895655 2.315181 -1.277685
C -1.380152 2.706131 1.443171
C -1.032646 3.335223 -0.866513
C -0.771593 3.532688 0.492505
H -0.204625 -0.410248 0.859852
H 0.356822 0.750478 -0.378818
H 1.200019 -0.225911 -2.630390
H 1.150776 -2.007359 -2.826893
H 2.121168 0.463099 1.330999
H 2.075674 -1.320059 1.163346
H 2.899051 -2.320612 -1.104374
H 3.474184 -1.159391 -2.345768
H -1.143394 -2.085765 -2.329353
H -1.340687 -0.351789 -1.966326
H 4.501919 -0.902221 0.891329
H 5.054701 -0.598931 -0.773197
H 4.541709 1.883550 -0.494469
H 4.050155 1.601181 1.182370
H -0.972942 -3.538014 -0.001337
H -4.489006 0.725779 -0.560114
H -3.415940 0.258919 -1.870438
H -4.917527 -0.755939 1.168986
H -2.560765 -4.305513 1.755144
H -4.538114 -2.906283 2.335604
H -2.711881 1.040207 1.780955
H -2.095373 2.175012 -2.337524
H -1.182480 2.859896 2.502950
H -0.562490 3.978045 -1.609297
H -0.100151 4.327292 0.809696


%chk=000216746-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000216746

0 1
N 0.485040 -1.199373 -0.920901
N 3.258351 -0.454515 -0.503947
N 7.791288 0.471530 1.197440
C 0.873867 -0.267099 0.167342
C 1.426750 -1.079221 -2.059089
C 2.307385 -0.560776 0.634118
C 2.860801 -1.382583 -1.594863
C -0.930499 -1.024696 -1.331401
C 4.671034 -0.618432 -0.105307
C -1.921943 -1.542953 -0.287715
C -3.203087 -0.942694 -0.103308
C 5.211365 0.679431 0.562011
C -1.578271 -2.688792 0.471956
C -3.640775 0.303217 -0.873106
C -4.097671 -1.516320 0.836765
C -2.476568 -3.246886 1.406589
C -2.939358 1.602171 -0.455736
C -3.748126 -2.658566 1.589871
C 6.634976 0.573835 0.919452
C -2.642745 1.870923 0.905089
C -2.611219 2.583111 -1.426489
C -2.036947 3.089782 1.284918
C -2.006508 3.803957 -1.050524
C -1.716010 4.062049 0.309015
H 0.175120 -0.397549 1.012641
H 0.809336 0.797276 -0.170093
H 1.406060 -0.053640 -2.507341
H 1.135307 -1.803981 -2.842611
H 2.584997 0.170358 1.415253
H 2.340547 -1.582184 1.090481
H 2.910580 -2.450668 -1.265554
H 3.557002 -1.249085 -2.443686
H -1.071476 -1.601106 -2.269242
H -1.149575 0.041324 -1.574819
H 4.827692 -1.482205 0.586614
H 5.269016 -0.817053 -1.013245
H 5.064838 1.522098 -0.138332
H 4.635985 0.914206 1.476912
H -0.584252 -3.122330 0.315414
H -4.731210 0.433484 -0.723017
H -3.502614 0.160444 -1.962321
H -5.084282 -1.056491 0.976254
H -2.189604 -4.134100 1.982563
H -4.458596 -3.082410 2.308463
H -2.880373 1.117859 1.665374
H -2.833140 2.390087 -2.484094
H -1.816083 3.281514 2.341428
H -1.760309 4.549666 -1.815143
H -1.245998 5.007085 0.603523


