%chk=000214377.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214377

0 1
N 3.575542 -1.209394 -0.393872
N -0.658135 -0.711901 0.198772
C 1.579479 0.251625 -0.149960
C 2.062651 0.997508 1.127575
C 2.092761 -1.210200 -0.166263
C 1.960332 2.530060 0.975993
C 0.069199 0.292739 -0.292758
C 1.309862 0.545356 2.382300
C 2.917985 3.085461 -0.075047
C -0.535224 1.417124 -0.966420
C 3.893987 -1.100069 -1.849297
C 4.194480 -2.442824 0.177513
C -2.043418 -0.668135 0.067894
C -1.896381 1.471175 -1.101320
C -2.705364 0.413163 -0.578200
C -2.813271 -1.752210 0.604780
C -4.129505 0.396064 -0.677772
C -4.179969 -1.735692 0.491341
C -4.846138 -0.652281 -0.155631
H 2.025870 0.782301 -1.033737
H 3.147055 0.732318 1.252055
H 1.859912 -1.685137 0.813416
H 1.536023 -1.799328 -0.925674
H 0.920223 2.823089 0.739157
H 2.180810 3.001416 1.954956
H 1.251260 -0.550119 2.433481
H 0.277693 0.912779 2.399240
H 1.804656 0.894794 3.293117
H 2.829159 4.173610 -0.158296
H 2.726146 2.657036 -1.065953
H 3.961493 2.856701 0.175326
H 0.106115 2.206367 -1.353192
H 3.442207 -0.177935 -2.248426
H 3.550844 -1.945369 -2.463467
H 4.984875 -1.005287 -1.968737
H 3.821016 -3.387544 -0.243263
H 4.023842 -2.454596 1.266317
H 5.284424 -2.402628 0.023123
H -2.382677 2.307488 -1.603387
H -2.282362 -2.568723 1.095253
H -4.629826 1.226899 -1.172955
H -4.781086 -2.550571 0.894065
H -5.932245 -0.675727 -0.225449


%chk=000214377-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000214377

0 1
N 3.547927 -1.338739 -0.242019
N -0.675164 -0.703507 0.187029
C 1.565713 0.242203 -0.247447
C 2.098709 0.997144 1.028652
C 2.071123 -1.226839 -0.295182
C 1.973258 2.542754 0.925823
C 0.047270 0.291641 -0.376970
C 1.450475 0.496556 2.340527
C 2.815979 3.193859 -0.194586
C -0.582304 1.382948 -1.077237
C 4.214444 -0.883794 -1.477928
C 3.988645 -2.693145 0.148276
C -2.061020 -0.660961 0.095508
C -1.970766 1.441290 -1.177078
C -2.766204 0.408216 -0.582324
C -2.816130 -1.718855 0.696267
C -4.196908 0.384446 -0.635378
C -4.212245 -1.717131 0.630667
C -4.908478 -0.659498 -0.038673
H 1.977811 0.777863 -1.125606
H 3.178293 0.740414 1.063619
H 1.645296 -1.774027 0.562165
H 1.654733 -1.714981 -1.213903
H 0.907177 2.827205 0.810929
H 2.296228 2.969266 1.897439
H 1.528248 -0.599232 2.447452
H 0.377684 0.758308 2.391337
H 1.955669 0.957081 3.210462
H 2.744008 4.296674 -0.155141
H 2.489095 2.880373 -1.204288
H 3.883486 2.921029 -0.091713
H 0.045968 2.155025 -1.533579
H 3.985366 0.178224 -1.673281
H 3.911350 -1.474089 -2.381208
H 5.309716 -0.972999 -1.362531
H 3.711302 -3.484120 -0.595016
H 3.537105 -2.965284 1.118520
H 5.087828 -2.708548 0.264626
H -2.462424 2.265337 -1.707836
H -2.261465 -2.515411 1.201915
H -4.725750 1.196426 -1.149691
H -4.783591 -2.529230 1.093870
H -6.003157 -0.674491 -0.079870


