%chk=000212942.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212942

1 1
N 1.208604 -0.553170 -0.044016
N -5.292454 -0.126853 0.052361
C 2.620166 -0.341483 -0.003586
C 0.331765 0.474802 -0.277099
C 3.102013 0.920792 -0.460695
C 3.571584 -1.307825 0.473692
C -1.108235 0.274987 -0.191890
C 0.837994 1.763628 -0.643418
C 2.178016 1.973611 -0.775909
C 0.659241 -1.927964 0.074825
C 4.498842 1.154633 -0.583105
C 4.925813 -1.036588 0.325977
C -1.936096 0.624711 -1.286861
C -1.722283 -0.190496 0.995959
C -3.933645 0.010969 -0.024504
C 5.397357 0.177330 -0.221343
C 3.208921 -2.571453 1.180136
C -3.304770 0.488027 -1.222526
C -3.088820 -0.321217 1.087364
C -5.990402 -0.589684 1.272076
C -6.175735 0.223477 -1.083240
H 0.108239 2.564934 -0.813319
H 2.572821 2.944214 -1.100636
H 0.550418 -2.234373 1.131363
H -0.342902 -2.007553 -0.400609
H 1.305680 -2.658712 -0.450767
H 4.845385 2.119231 -0.963656
H 5.665489 -1.774151 0.658496
H -1.475029 0.996352 -2.206297
H -1.100479 -0.429553 1.861767
H 6.474863 0.334192 -0.329583
H 2.446860 -2.419154 1.957807
H 2.864487 -3.356620 0.489077
H 4.074325 -3.009979 1.709906
H -3.908121 0.752678 -2.088500
H -3.542021 -0.667212 2.017592
H -6.565394 -1.510984 1.062609
H -6.690252 0.184877 1.638149
H -5.288106 -0.816061 2.095869
H -7.234556 0.019460 -0.844115
H -5.924350 -0.371279 -1.980957
H -6.097434 1.297761 -1.334193


%chk=000212942-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212942

1 1
N 1.229355 -0.592205 -0.097610
N -5.353074 -0.101405 0.115265
C 2.633012 -0.343867 0.000099
C 0.326603 0.407872 -0.465611
C 3.141439 0.861134 -0.615607
C 3.539653 -1.230333 0.678526
C -1.115523 0.217433 -0.333243
C 0.848243 1.630589 -0.995846
C 2.213033 1.827067 -1.127419
C 0.762189 -2.015423 -0.124727
C 4.545514 1.102891 -0.674666
C 4.919968 -0.943308 0.578759
C -2.015583 0.811575 -1.276017
C -1.701298 -0.477002 0.774648
C -3.985413 0.002422 -0.029093
C 5.434283 0.185008 -0.113072
C 3.132711 -2.370334 1.604184
C -3.399557 0.700088 -1.144732
C -3.083206 -0.575418 0.934430
C -5.932953 -0.837195 1.257625
C -6.259520 0.528027 -0.867268
H 0.138928 2.410704 -1.277531
H 2.600914 2.747837 -1.575553
H 0.590317 -2.431287 0.877690
H -0.179046 -2.058864 -0.690651
H 1.521636 -2.617394 -0.645854
H 4.905650 2.019559 -1.153264
H 5.621247 -1.610106 1.092425
H -1.616809 1.329334 -2.155463
H -1.057270 -0.890844 1.558127
H 6.514452 0.349557 -0.160092
H 2.304706 -2.080009 2.274541
H 2.834769 -3.290504 1.072099
H 3.987568 -2.637133 2.246402
H -4.036949 1.146017 -1.911709
H -3.474266 -1.079094 1.821538
H -7.028739 -0.841602 1.169429
H -5.669653 -0.361543 2.221629
H -5.588831 -1.888188 1.275443
H -7.301831 0.359728 -0.561108
H -6.125251 0.094488 -1.876503
H -6.093619 1.620030 -0.926020


