%chk=000234403.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000234403

0 1
S -0.297578 -0.240643 -0.937392
S -3.154051 -0.516225 -1.977784
N 1.852286 0.193273 0.609633
N -2.561653 0.100744 0.501695
C 2.509598 1.401515 0.198139
C 2.523758 -1.077888 0.439607
C 0.413407 0.154669 0.752219
C 3.898652 1.514689 0.429771
C 3.316019 -1.329023 -0.695474
C 1.800369 2.485067 -0.351714
C 2.384062 -2.054400 1.442199
C -2.002172 -0.179547 -0.644431
C -4.487053 -0.251430 -0.879298
C -3.981775 0.070346 0.411529
C 4.555729 2.701171 0.112294
C 3.966741 -2.557592 -0.817437
C 2.479076 3.667824 -0.656845
C 3.037907 -3.279832 1.298257
C 3.852323 3.783246 -0.430407
C 3.829377 -3.535051 0.173968
C -5.853605 -0.319956 -1.127113
C -4.866022 0.327402 1.470418
C -6.723694 -0.062235 -0.065792
C -6.233843 0.256947 1.214858
H 0.082844 -0.644282 1.452660
H -0.008330 1.120374 1.108896
H 4.453252 0.684821 0.865636
H 3.418458 -0.574092 -1.474626
H 0.733749 2.418973 -0.557860
H 1.781666 -1.856834 2.326772
H 5.627147 2.787254 0.293148
H 4.580608 -2.756546 -1.695802
H 1.925736 4.505741 -1.081487
H 2.930944 -4.040243 2.071687
H 4.372448 4.706173 -0.673069
H 4.335750 -4.492224 0.069533
H -6.235951 -0.566540 -2.116069
H -4.478543 0.573639 2.457818
H -7.799934 -0.108143 -0.228156
H -6.942003 0.452356 2.020517


%chk=000234403-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000234403

0 1
S -0.571069 1.712306 -1.226470
S -3.277814 0.416845 -2.121589
N 1.703739 0.987494 0.440939
N -2.326404 0.288268 0.401642
C 2.819962 1.796994 0.044735
C 1.814514 -0.456800 0.467620
C 0.414249 1.564557 0.550247
C 4.145963 1.376872 0.344537
C 2.444203 -1.149648 -0.597483
C 2.623712 3.047849 -0.601578
C 1.260773 -1.185659 1.549083
C -2.029002 0.769459 -0.787159
C -4.237097 -0.457148 -0.848981
C -3.552478 -0.407371 0.410411
C 5.243295 2.191101 0.002210
C 2.525111 -2.558042 -0.571303
C 3.731624 3.858725 -0.931858
C 1.334124 -2.595367 1.561906
C 5.047353 3.439283 -0.636435
C 1.968955 -3.288070 0.505342
C -5.473561 -1.113469 -0.992078
C -4.128568 -1.031545 1.541549
C -6.034285 -1.732492 0.149537
C -5.367010 -1.690387 1.402517
H -0.301866 0.946801 1.109552
H 0.438727 2.603972 0.900984
H 4.310123 0.422683 0.854408
H 2.857700 -0.586232 -1.439860
H 1.618129 3.388109 -0.869192
H 0.787999 -0.652058 2.380684
H 6.256547 1.852929 0.246601
H 3.008538 -3.085820 -1.400789
H 3.560644 4.817872 -1.433302
H 0.902958 -3.150935 2.401839
H 5.903511 4.069837 -0.897668
H 2.027192 -4.381678 0.519140
H -5.992771 -1.149216 -1.954640
H -3.604557 -0.990479 2.501120
H -6.995708 -2.249700 0.061860
H -5.821755 -2.176345 2.272418


