%chk=000284830.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000284830

0 1
S -2.721415 0.832244 -1.524512
N 3.598100 0.008737 -0.503814
N -1.052664 0.044911 0.987003
C 2.861773 0.179095 0.795325
C 1.372727 0.147282 0.304341
C 2.823609 -0.914280 -1.409303
C 1.362038 -0.844017 -0.872223
C 0.361720 -0.200859 1.407438
C 3.211338 1.551299 1.391649
C 3.163039 -0.925702 1.827230
C 2.919761 -0.348726 -2.835848
C 3.317033 -2.374808 -1.398685
C 5.053307 -0.250746 -0.397513
C -1.710610 -1.001819 0.270239
C -1.452905 1.411704 0.854672
C -2.562942 -0.762485 -0.823538
C -2.282482 1.868941 -0.185469
C -1.565607 -2.331898 0.727212
C -1.061209 2.331754 1.853488
C -3.273345 -1.798345 -1.430678
C -2.740017 3.186343 -0.223170
C -2.261840 -3.366830 0.105612
C -1.504357 3.652336 1.801915
C -3.118289 -3.108395 -0.970605
C -2.345456 4.085533 0.770747
H 1.126733 1.165110 -0.093765
H 1.001807 -1.838047 -0.559499
H 0.658447 -0.512001 -1.655084
H 0.563114 0.410264 2.318064
H 0.460465 -1.264708 1.720646
H 3.167392 2.334141 0.621834
H 2.521414 1.828663 2.192525
H 4.225918 1.568936 1.801847
H 2.639476 -0.756462 2.771415
H 2.877201 -1.912592 1.447901
H 4.231372 -0.965225 2.065763
H 2.293945 -0.912064 -3.532987
H 2.597353 0.700588 -2.858900
H 3.947747 -0.369980 -3.210518
H 3.351011 -2.781224 -0.382974
H 2.656236 -3.014495 -1.992710
H 4.319446 -2.468349 -1.827358
H 5.489656 -0.244203 -1.410084
H 5.322779 -1.200043 0.089353
H 5.522194 0.573535 0.164631
H -0.917893 -2.546949 1.576083
H -0.420233 2.006591 2.671678
H -3.944359 -1.590934 -2.266534
H -3.398178 3.519029 -1.028110
H -2.141491 -4.387844 0.467851
H -1.194950 4.352709 2.577761
H -3.662800 -3.921182 -1.444637
H -2.691408 5.115868 0.742693


%chk=000284830-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000284830

0 1
S -2.915355 0.257624 -1.801543
N 3.778537 0.108864 -0.249321
N -0.980082 -0.160343 0.526357
C 2.921109 -0.131995 0.949979
C 1.509338 0.064096 0.306769
C 3.121701 -0.364441 -1.520300
C 1.640952 -0.607619 -1.080710
C 0.331287 -0.473300 1.145123
C 3.196280 0.939495 2.032973
C 3.105925 -1.551847 1.574813
C 3.216066 0.757800 -2.587993
C 3.739695 -1.671693 -2.096000
C 5.231478 -0.018862 -0.127674
C -1.975452 -1.181756 0.428492
C -1.352800 1.205954 0.337297
C -2.983863 -1.106183 -0.573489
C -2.301250 1.561458 -0.662262
C -2.014210 -2.284157 1.326490
C -0.814047 2.246513 1.142923
C -3.987349 -2.088372 -0.679214
C -2.715271 2.896051 -0.837909
C -2.995493 -3.291140 1.195245
C -1.199492 3.589428 0.942473
C -3.987313 -3.200897 0.193870
C -2.153970 3.923081 -0.043864
H 1.388714 1.153488 0.157453
H 1.439214 -1.693596 -0.998082
H 0.921540 -0.198354 -1.809949
H 0.387015 -0.097458 2.190522
H 0.410235 -1.571002 1.193725
H 3.156436 1.946807 1.582414
H 2.448366 0.879095 2.846454
H 4.190839 0.805521 2.497867
H 2.506491 -1.668370 2.497425
H 2.815944 -2.352507 0.870693
H 4.165074 -1.709067 1.849965
H 2.773733 0.431611 -3.548507
H 2.683283 1.660219 -2.240902
H 4.269934 1.037461 -2.776173
H 3.749412 -2.479479 -1.341348
H 3.144692 -2.018828 -2.961027
H 4.776778 -1.512762 -2.445234
H 5.717553 0.401350 -1.027756
H 5.606451 -1.064202 -0.005248
H 5.592328 0.569643 0.735459
H -1.288460 -2.350337 2.142755
H -0.094496 2.007982 1.931461
H -4.756050 -1.989079 -1.453064
H -3.461346 3.130380 -1.604725
H -2.992752 -4.136216 1.892458
H -0.758771 4.372730 1.568867
H -4.754690 -3.975417 0.096167
H -2.460190 4.963030 -0.195796


