%chk=000244013.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244013

0 1
N 3.112924 -2.765869 0.279448
N -5.176415 -0.898501 -0.673664
C 1.983513 1.389932 -0.251341
C 0.710694 1.720428 0.557504
C -0.506482 0.941502 0.045004
C 3.135518 2.340243 0.143034
C 2.382591 -0.057580 -0.053963
C -1.763664 1.262927 0.868414
C 4.360494 2.157649 -0.747753
C -2.951788 0.513679 0.333664
C 2.375065 -0.943609 -1.142339
C 2.761768 -0.550348 1.204523
C -3.852252 1.130983 -0.547492
C -3.179052 -0.821580 0.701626
C 2.744555 -2.281333 -0.935216
C 3.118070 -1.900948 1.328302
C -4.946573 0.393828 -1.024985
C -4.296621 -1.488348 0.178592
H 1.758409 1.562093 -1.335986
H 0.875558 1.504411 1.630639
H 0.511255 2.808358 0.497409
H -0.688750 1.175902 -1.022281
H -0.304003 -0.148639 0.081923
H 2.782619 3.388691 0.077794
H 3.415245 2.182098 1.202769
H -1.953965 2.355608 0.860779
H -1.595592 1.004351 1.934668
H 4.133293 2.358154 -1.800860
H 5.169542 2.835529 -0.452192
H 4.754167 1.134646 -0.688507
H 2.089587 -0.605425 -2.134705
H 2.782988 0.102703 2.072507
H -3.708337 2.161498 -0.859168
H -2.500456 -1.334526 1.378015
H 2.750487 -3.002375 -1.760994
H 3.420929 -2.321920 2.294010
H -5.673536 0.839736 -1.713731
H -4.509590 -2.531349 0.440856


%chk=000244013-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244013

0 1
N 3.179780 -2.829542 0.250391
N -5.285458 -0.922750 -0.640326
C 2.021640 1.390889 -0.261144
C 0.717862 1.718960 0.526667
C -0.523608 0.945066 0.033132
C 3.169384 2.362074 0.148646
C 2.426870 -0.072314 -0.086839
C -1.799216 1.294453 0.850879
C 4.448007 2.210631 -0.701914
C -3.021703 0.540681 0.357828
C 2.460350 -0.973981 -1.179488
C 2.784517 -0.597368 1.183463
C -3.943753 1.125787 -0.546969
C -3.269444 -0.800962 0.747980
C 2.835784 -2.321283 -0.970296
C 3.147453 -1.956099 1.303250
C -5.043716 0.370080 -1.012273
C -4.394115 -1.482690 0.233100
H 1.813826 1.558246 -1.339304
H 0.878628 1.510775 1.604889
H 0.525735 2.808596 0.444831
H -0.704879 1.172442 -1.036894
H -0.341495 -0.145071 0.095465
H 2.788938 3.399690 0.062588
H 3.413632 2.208635 1.219222
H -1.977473 2.385782 0.791268
H -1.610133 1.054189 1.915835
H 4.236237 2.391197 -1.772816
H 5.221585 2.933517 -0.385218
H 4.875052 1.195868 -0.609982
H 2.196305 -0.633503 -2.187273
H 2.784665 0.038825 2.075841
H -3.812139 2.160891 -0.883134
H -2.598188 -1.310378 1.449187
H 2.865295 -3.030234 -1.805881
H 3.427112 -2.376881 2.276234
H -5.768370 0.806965 -1.709411
H -4.602772 -2.518583 0.524768


