%chk=000191408.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191408

0 1
N -1.202239 0.660579 -0.680794
N 2.018992 2.881791 1.209407
C 1.674227 0.576492 -0.011744
C 0.601429 -0.217398 0.779318
C 1.149136 0.872165 -1.441678
C -0.768102 0.475535 0.743297
C -0.234226 1.538995 -1.418893
C 2.970103 -0.227880 -0.095325
C -2.582646 1.250334 -0.745695
C 1.886505 1.866026 0.675937
C 4.189313 0.272924 0.379773
C 2.937340 -1.508382 -0.674288
C -3.603238 0.279234 -0.200135
C 5.355056 -0.494767 0.279810
C 4.101734 -2.271808 -0.772906
C -3.618462 -1.053754 -0.639004
C -4.560591 0.716894 0.726384
C 5.315917 -1.766852 -0.295294
C -4.584582 -1.938421 -0.155348
C -5.527872 -0.172402 1.204520
C -5.542342 -1.499507 0.765578
H 0.926155 -0.361618 1.826823
H 0.504005 -1.233202 0.343195
H 1.084052 -0.079982 -2.007872
H 1.868376 1.509061 -1.989807
H -1.520331 -0.174138 1.247060
H -0.735429 1.428575 1.314761
H -0.160439 2.562647 -0.990309
H -0.599867 1.652135 -2.463485
H -2.822469 1.441411 -1.819277
H -2.656541 2.233778 -0.229983
H 4.253866 1.262335 0.833339
H 1.997239 -1.913711 -1.050101
H 6.296588 -0.094144 0.654048
H 4.063860 -3.262888 -1.222804
H -2.863272 -1.391913 -1.349804
H -4.556496 1.746873 1.076366
H 6.223714 -2.362188 -0.371774
H -4.592784 -2.972040 -0.496772
H -6.271044 0.171411 1.921814
H -6.295734 -2.189502 1.138962


%chk=000191408-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191408

0 1
N -1.214096 0.720540 -0.590091
N 2.142590 2.940112 1.157343
C 1.716659 0.576154 -0.025350
C 0.631923 -0.193631 0.811602
C 1.117284 0.853010 -1.451549
C -0.729990 0.522805 0.799354
C -0.260622 1.535933 -1.381685
C 3.026997 -0.239736 -0.125739
C -2.591536 1.271344 -0.633835
C 1.966469 1.883302 0.631826
C 4.264526 0.252324 0.357486
C 2.996864 -1.527147 -0.724885
C -3.648658 0.285754 -0.144040
C 5.442835 -0.521079 0.245879
C 4.172156 -2.299679 -0.836980
C -3.577348 -1.085027 -0.500701
C -4.744256 0.733827 0.633648
C 5.403044 -1.799890 -0.351506
C -4.583815 -1.986800 -0.090950
C -5.756633 -0.165702 1.041687
C -5.679709 -1.530051 0.679897
H 0.986415 -0.320891 1.850539
H 0.513566 -1.198412 0.368573
H 1.008555 -0.118486 -1.965939
H 1.821153 1.471992 -2.037060
H -1.469291 -0.092547 1.341889
H -0.649001 1.499329 1.341976
H -0.147591 2.567250 -0.959231
H -0.660444 1.645412 -2.407305
H -2.801229 1.530484 -1.691658
H -2.678477 2.223291 -0.050858
H 4.312247 1.242928 0.823208
H 2.054843 -1.936717 -1.108516
H 6.389512 -0.121697 0.626410
H 4.127743 -3.290800 -1.302207
H -2.718395 -1.427603 -1.088684
H -4.805161 1.790516 0.923965
H 6.315778 -2.399626 -0.438018
H -4.516910 -3.044233 -0.372430
H -6.597942 0.195916 1.643922
H -6.461157 -2.229771 0.997315


