%chk=000241407.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241407

0 1
S -2.453107 -0.954387 -0.052620
N 2.469645 -0.586107 0.639233
N 0.647048 -1.944389 0.261676
N 1.298927 1.625258 0.644409
N -1.148560 1.359300 0.293749
N -0.138862 3.495995 0.482823
C 4.630836 -0.049253 -0.566091
C 3.875883 -0.177044 0.783520
C 1.367631 0.260457 0.531961
C 3.945632 0.955163 -1.492780
C 4.799248 -1.408048 -1.249744
C 0.225714 -0.606883 0.307094
C -5.061919 -0.527666 -0.603164
C 1.970568 -1.918336 0.446767
C -3.816728 0.245757 -0.152385
C -1.032985 0.022699 0.197192
C -5.565144 -1.473632 0.492534
C -6.160789 0.473150 -0.992885
C 0.020653 2.114791 0.493331
H 5.650510 0.344088 -0.312494
H 4.392586 -0.910888 1.441817
H 3.897876 0.809269 1.310456
H 3.717052 1.896191 -0.974801
H 2.990092 0.573558 -1.874983
H 4.570756 1.192214 -2.359411
H 3.836355 -1.823796 -1.572013
H 5.279761 -2.141361 -0.595224
H 5.418353 -1.318312 -2.150804
H -4.812692 -1.134973 -1.512334
H 2.628033 -2.775421 0.474507
H -3.557402 1.054204 -0.864409
H -3.963665 0.737295 0.826948
H -5.806064 -0.936124 1.416367
H -6.472142 -2.000077 0.175323
H -4.821903 -2.238633 0.748405
H -6.446316 1.111999 -0.150106
H -7.065468 -0.046922 -1.327210
H -5.839242 1.126997 -1.810677
H -1.071341 3.868324 0.589527
H 0.617671 4.066244 0.831995


%chk=000241407-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241407

0 1
S -2.491115 -1.152968 -0.094490
N 2.480912 -0.591041 0.559310
N 0.709635 -2.032166 0.248780
N 1.256478 1.558335 0.579719
N -1.168646 1.239577 0.261379
N -0.241022 3.367892 0.556826
C 4.703795 0.009900 -0.537222
C 3.858034 -0.103537 0.763459
C 1.336991 0.206359 0.477509
C 4.050092 0.961926 -1.564589
C 5.007461 -1.370788 -1.163760
C 0.248375 -0.701810 0.281197
C -5.191859 -0.478214 -0.591222
C 2.037142 -1.923063 0.419764
C -3.852213 0.172377 -0.188740
C -1.036739 -0.107755 0.169049
C -5.710856 -1.465988 0.480385
C -6.231032 0.640594 -0.857433
C -0.034686 2.007847 0.465030
H 5.666682 0.457792 -0.210299
H 4.360810 -0.780356 1.479989
H 3.767937 0.892713 1.232552
H 3.810715 1.941317 -1.113347
H 3.106231 0.535090 -1.950774
H 4.723964 1.125990 -2.425214
H 4.081709 -1.853244 -1.528109
H 5.491518 -2.051983 -0.437996
H 5.685833 -1.262027 -2.029318
H -5.036107 -1.034614 -1.538461
H 2.727381 -2.762680 0.465084
H -3.514793 0.918721 -0.925758
H -3.911049 0.658048 0.800031
H -5.883879 -0.941586 1.439929
H -6.667700 -1.919357 0.162637
H -4.990316 -2.282391 0.666796
H -6.404047 1.241523 0.056010
H -7.199936 0.204761 -1.163085
H -5.895650 1.324314 -1.659281
H -1.186999 3.729058 0.480583
H 0.553450 3.982133 0.708582


