%chk=000213570.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213570

0 1
N 2.385615 0.229859 0.540141
N -2.385000 0.228923 0.542013
N 0.000292 0.108333 0.444984
N -1.209558 2.228874 0.142374
N 1.209083 2.229351 0.141469
C 2.527623 -1.252348 0.608307
C -2.526306 -1.253361 0.610237
C 2.561609 -1.874741 -0.803845
C 3.802605 -1.588544 1.409312
C -3.801404 -1.590107 1.410819
C -2.559480 -1.875963 -0.801838
C 3.857534 -1.559281 -1.558003
C 5.094637 -1.295586 0.636697
C -5.093304 -1.297850 0.637714
C -3.855269 -1.561164 -1.556502
C 5.091739 -1.967295 -0.742824
C -5.089582 -1.969690 -0.741743
C 1.168770 0.849978 0.361056
C -1.168537 0.849522 0.361927
C -0.000399 2.857085 0.038240
C -0.000795 4.344092 -0.211848
C -0.000606 4.630028 -1.711441
H 1.632303 -1.658114 1.157808
H -1.630960 -1.658573 1.160106
H 1.685666 -1.522420 -1.383975
H 2.439031 -2.970810 -0.709527
H 3.767347 -2.662649 1.678988
H 3.802346 -1.036185 2.369486
H -3.801768 -1.037689 2.370957
H -3.765719 -2.664176 1.680590
H -1.683470 -1.523327 -1.381684
H -2.436443 -2.971961 -0.707331
H 3.901802 -0.478894 -1.796207
H 3.859259 -2.082601 -2.532905
H 5.965226 -1.645404 1.224009
H 5.230865 -0.203023 0.522443
H -5.230024 -0.205366 0.523298
H -5.963932 -1.648036 1.224747
H -3.856392 -2.084550 -2.531366
H -3.899946 -0.480810 -1.794789
H 6.013037 -1.700576 -1.293652
H 5.114664 -3.067620 -0.623706
H -6.010803 -1.703459 -1.292934
H -5.112028 -3.070014 -0.622529
H 3.227788 0.774507 0.347845
H -3.227531 0.773208 0.350237
H -0.893332 4.802429 0.267552
H 0.891307 4.802934 0.267874
H 0.885918 4.203234 -2.198597
H -0.000848 5.708349 -1.905068
H -0.886729 4.202780 -2.198919


%chk=000213570-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000213570

0 1
N 2.355565 0.249814 0.517767
N -2.354902 0.248751 0.518691
N 0.000346 0.154045 0.498369
N -1.213721 2.266929 0.238161
N 1.213351 2.267479 0.237722
C 2.512150 -1.207287 0.704322
C -2.510751 -1.208387 0.705508
C 2.373092 -1.978652 -0.639619
C 3.882371 -1.502349 1.363824
C -3.880801 -1.504096 1.365095
C -2.371311 -1.979853 -0.638328
C 3.556874 -1.700949 -1.594519
C 5.075312 -1.241934 0.408519
C -5.073908 -1.244433 0.409785
C -3.555253 -1.702861 -1.593232
C 4.912112 -2.022952 -0.918464
C -4.910308 -2.025510 -0.917119
C 1.151975 0.894553 0.413727
C -1.151647 0.894017 0.414095
C -0.000344 2.890156 0.152492
C -0.000706 4.380742 -0.097213
C -0.000188 4.692504 -1.618205
H 1.694004 -1.529923 1.375092
H -1.692381 -1.530463 1.376261
H 1.409615 -1.706651 -1.107931
H 2.330314 -3.063434 -0.409340
H 3.891487 -2.570308 1.658459
H 3.986315 -0.909166 2.292711
H -3.985018 -0.910848 2.293908
H -3.889352 -2.572025 1.659862
H -1.407993 -1.707413 -1.106723
H -2.327971 -3.064586 -0.407920
H 3.540740 -0.634073 -1.896855
H 3.441322 -2.294582 -2.521590
H 6.019872 -1.526749 0.910391
H 5.162967 -0.157562 0.184384
H -5.162134 -0.160131 0.185525
H -6.018310 -1.529682 0.911708
H -3.439413 -2.296521 -2.520248
H -3.539680 -0.636004 -1.895664
H 5.749758 -1.790231 -1.603947
H 4.962758 -3.111124 -0.705547
H -5.748082 -1.793306 -1.602619
H -4.960371 -3.113686 -0.704088
H 3.176832 0.852028 0.441798
H -3.176476 0.850560 0.442822
H -0.900509 4.816614 0.370375
H 0.898475 4.817178 0.371056
H 0.896243 4.265112 -2.101393
H -0.000438 5.783948 -1.789745
H -0.895982 4.264600 -2.102125


