%chk=000298973.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298973

0 1
N -3.597432 -0.371618 -0.155314
N 1.933224 -3.491658 -1.357759
C 1.772421 -1.347875 0.162757
C 0.515096 -1.559466 1.053332
C 3.083530 -1.319548 1.035047
C -0.796953 -1.489175 0.264402
C -2.004073 -1.778656 1.165239
C -3.327325 -1.746442 0.379941
C -3.973938 0.604269 0.920895
C -4.762721 -0.367201 -1.103368
C -5.516275 0.683824 0.988755
C -6.026860 0.048069 -0.317245
C 1.651037 -0.057585 -0.656327
C 4.310050 -1.021030 0.169765
C 3.285337 -2.623567 1.812602
C 1.525847 1.235053 -0.021706
C 1.862089 -2.536001 -0.712027
C 1.661242 -0.124056 -2.033674
C 1.419520 2.395293 -0.838135
C 1.552014 1.041607 -2.842821
C 1.500753 1.428829 1.397273
C 1.434515 2.276101 -2.263594
C 1.296114 3.689049 -0.235512
C 1.381862 2.675902 1.956407
C 1.277824 3.828935 1.128181
H 0.505468 -0.800099 1.862286
H 0.593391 -2.540014 1.565658
H 2.965495 -0.488816 1.779414
H -0.778945 -2.201524 -0.582934
H -0.919457 -0.485931 -0.199477
H -1.897473 -2.773206 1.639646
H -2.038768 -1.044047 1.993900
H -3.254713 -2.439093 -0.487966
H -4.149209 -2.127028 1.023466
H -3.542432 1.583594 0.622366
H -3.525904 0.339962 1.895573
H -4.888925 -1.336256 -1.616470
H -4.524681 0.383460 -1.887508
H -5.903128 0.144694 1.868361
H -5.854473 1.727262 1.088574
H -6.640124 0.755059 -0.897941
H -6.668365 -0.823244 -0.108503
H 4.220944 -0.054606 -0.342555
H 4.466823 -1.785240 -0.601022
H 5.221889 -0.983251 0.776402
H 3.476882 -3.476258 1.148436
H 2.416250 -2.878299 2.428534
H 4.149568 -2.546663 2.483109
H 1.750720 -1.073674 -2.564391
H 1.562349 0.925329 -3.926178
H 1.577519 0.550405 2.047820
H 1.348517 3.177112 -2.868431
H 1.215797 4.558737 -0.886683
H 1.364611 2.803100 3.037446
H 1.184176 4.808180 1.593753


%chk=000298973-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298973

0 1
N -3.609131 -0.218442 0.055938
N 2.030659 -3.528164 -1.393590
C 1.810420 -1.353821 0.158015
C 0.506329 -1.629059 1.009847
C 3.131216 -1.344077 1.058273
C -0.811939 -1.493992 0.220351
C -2.034871 -1.902239 1.069608
C -3.376705 -1.663315 0.341414
C -4.139186 0.545381 1.224810
C -4.622490 0.038243 -1.006737
C -5.712275 0.473918 1.152661
C -6.017576 -0.012334 -0.301363
C 1.703478 -0.050235 -0.690719
C 4.406199 -1.177399 0.197870
C 3.251498 -2.593082 1.963106
C 1.536732 1.266531 -0.092450
C 1.932782 -2.534736 -0.739120
C 1.782409 -0.141996 -2.088249
C 1.468924 2.428124 -0.969517
C 1.711554 0.999963 -2.940119
C 1.427777 1.521091 1.320834
C 1.559629 2.268249 -2.389942
C 1.308243 3.741447 -0.414132
C 1.268830 2.810571 1.833073
C 1.209896 3.939807 0.961783
H 0.483990 -0.947258 1.879303
H 0.579366 -2.654556 1.418480
H 3.051810 -0.455118 1.710298
H -0.769010 -2.132338 -0.685992
H -0.961061 -0.456156 -0.126741
H -1.968951 -2.975973 1.342944
H -2.028205 -1.334450 2.023519
H -3.353057 -2.193589 -0.630236
H -4.204153 -2.119635 0.939848
H -3.806284 1.597363 1.144138
H -3.736192 0.138877 2.168190
H -4.514593 -0.684671 -1.833002
H -4.448998 1.052549 -1.417434
H -6.122063 -0.225765 1.902170
H -6.156641 1.465508 1.351103
H -6.765970 0.619596 -0.811171
H -6.403214 -1.048168 -0.293483
H 4.362921 -0.270499 -0.429494
H 4.554632 -2.049124 -0.466369
H 5.292886 -1.097735 0.852746
H 3.274099 -3.522164 1.363937
H 2.424106 -2.669836 2.689939
H 4.194733 -2.542724 2.537296
H 1.906383 -1.124635 -2.554346
H 1.778712 0.864248 -4.024643
H 1.460288 0.693766 2.030197
H 1.505262 3.157811 -3.028443
H 1.262139 4.593748 -1.102765
H 1.188336 2.956165 2.916076
H 1.087025 4.947025 1.374090


