%chk=000210611.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000210611

0 1
N -4.265554 0.043342 0.873146
N 4.504572 -0.178741 1.048798
C -1.073129 0.465241 -1.242893
C -0.030137 -0.377464 -0.497788
C -0.655360 1.879395 -0.884604
C 0.864065 0.409256 0.156407
C -2.519590 0.123243 -0.869667
C 0.507868 1.828453 -0.060380
C 2.042386 -0.008472 0.962757
C -2.820393 0.360232 0.620488
C -0.079863 -1.839494 -0.559809
C -1.217661 3.092099 -1.245602
C 1.101463 2.998152 0.394223
C 3.349073 0.195978 0.168553
C -0.611639 4.273306 -0.780811
C 0.528092 4.226782 0.024161
C -0.230646 -2.592489 0.617308
C 0.009848 -2.498319 -1.797624
C -4.747967 0.744374 2.101115
C -4.475827 -1.429425 1.007477
C -0.287942 -3.986640 0.553430
C -0.046411 -3.893082 -1.853227
C 5.683302 -0.583494 0.225663
C 4.873442 0.947455 1.957785
C -0.195883 -4.639591 -0.680062
H -0.940342 0.309987 -2.343397
H -2.724001 -0.934598 -1.132999
H -3.218863 0.727102 -1.482809
H 1.967978 -1.076286 1.263971
H 2.076130 0.559360 1.915708
H -2.122868 -0.231346 1.250378
H -2.633123 1.429315 0.864359
H -2.107992 3.136614 -1.867708
H 1.987665 2.969131 1.022745
H 3.332835 -0.469274 -0.722340
H 3.407553 1.235502 -0.217216
H -1.041475 5.235306 -1.054561
H 0.981077 5.153044 0.372615
H -0.305062 -2.085669 1.577842
H 0.131020 -1.921338 -2.712010
H -4.214187 0.482532 3.025824
H -5.817145 0.521037 2.244501
H -4.665063 1.832225 1.946263
H -3.975796 -1.892180 1.870487
H -4.114912 -1.930569 0.094381
H -5.556247 -1.628971 1.082504
H -0.402789 -4.566490 1.467766
H 0.027377 -4.400026 -2.813915
H 6.062443 0.190489 -0.456765
H 5.414741 -1.472794 -0.367576
H 6.503530 -0.883541 0.897442
H 5.237730 1.852681 1.450927
H 5.655078 0.601133 2.652840
H 3.997253 1.220626 2.567359
H -0.238951 -5.725498 -0.726561


%chk=000210611-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000210611

0 1
N -4.362581 0.141318 0.793542
N 4.663006 -0.094778 0.948771
C -1.018402 0.423710 -1.203263
C -0.003164 -0.420472 -0.407903
C -0.599401 1.848465 -0.873175
C 0.903070 0.402133 0.244881
C -2.513879 0.096937 -0.914868
C 0.544953 1.812372 -0.023054
C 2.141708 0.019804 1.024338
C -2.899408 0.254309 0.569826
C -0.066036 -1.897891 -0.419376
C -1.163037 3.070964 -1.271607
C 1.136447 3.015236 0.429488
C 3.438013 0.283919 0.205760
C -0.572648 4.278228 -0.814467
C 0.566354 4.247004 0.028617
C 0.109989 -2.667191 0.768120
C -0.356875 -2.599619 -1.625790
C -4.751535 0.642218 2.128036
C -4.883105 -1.221218 0.555326
C 0.028342 -4.075203 0.743334
C -0.438142 -4.007863 -1.651728
C 5.817906 -0.303425 0.050937
C 4.989522 0.835475 2.047678
C -0.240984 -4.755572 -0.467402
H -0.857213 0.246439 -2.290232
H -2.711966 -0.936327 -1.256969
H -3.157428 0.769444 -1.513875
H 2.144969 -1.047223 1.295821
H 2.174291 0.599588 1.968257
H -2.332330 -0.493214 1.183398
H -2.587586 1.258687 0.912522
H -2.046725 3.100515 -1.919992
H 2.014177 3.001463 1.085779
H 3.391728 -0.335414 -0.709270
H 3.468029 1.352448 -0.127631
H -0.999922 5.242136 -1.113275
H 1.007680 5.189096 0.373958
H 0.274202 -2.152272 1.720820
H -0.497044 -2.035397 -2.555396
H -4.319624 0.045073 2.972507
H -5.852118 0.621747 2.227124
H -4.416693 1.688421 2.244657
H -4.424143 -1.989424 1.230417
H -4.695792 -1.529598 -0.486990
H -5.976065 -1.230406 0.717140
H 0.164224 -4.642120 1.671433
H -0.652087 -4.522276 -2.595590
H 6.139165 0.624379 -0.488831
H 5.567909 -1.069184 -0.704524
H 6.680738 -0.670640 0.635811
H 5.205734 1.876742 1.691702
H 5.879753 0.468486 2.589202
H 4.157712 0.886792 2.770831
H -0.303985 -5.849226 -0.485925


