%chk=000255079.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000255079

0 1
S 7.082534 0.204380 0.114073
N 2.009073 -0.539526 0.536855
C -2.312781 -0.035412 0.360106
C -3.815193 -0.058260 -0.074123
C -1.447629 0.845359 -0.565800
C -1.700152 -1.449601 0.432001
C 0.613485 -0.514433 0.005163
C 0.005774 0.906077 -0.080749
C -0.249513 -1.405449 0.925286
C -4.377221 1.379445 -0.057401
C -3.989751 -0.651185 -1.483783
C -4.627763 -0.900252 0.932488
C 3.011834 0.050149 -0.400340
C 4.414777 -0.103261 0.217585
C 5.482981 0.386159 -0.750027
H -2.275722 0.406463 1.386591
H -1.863401 1.869596 -0.614350
H -1.482462 0.452128 -1.599792
H -1.744995 -1.932102 -0.563023
H -2.298166 -2.090347 1.107548
H 0.629165 -0.964611 -1.020852
H 0.601755 1.535864 -0.764985
H 0.051226 1.399992 0.907337
H -0.212308 -1.035835 1.966733
H 0.177386 -2.426869 0.954162
H -3.871247 2.021053 -0.785949
H -5.443881 1.389863 -0.303297
H -4.264770 1.843632 0.927037
H -3.619682 -1.680275 -1.535464
H -3.447964 -0.068705 -2.235579
H -5.043383 -0.667909 -1.780152
H -4.524132 -0.518379 1.952639
H -5.694386 -0.890734 0.686714
H -4.306455 -1.947038 0.937272
H 2.056695 -0.067240 1.445141
H 2.957542 -0.510883 -1.359870
H 2.813704 1.117065 -0.640202
H 4.468859 0.450879 1.177049
H 4.580231 -1.171208 0.482436
H 5.323536 1.442739 -1.030987
H 5.486304 -0.209511 -1.681156
H 7.902894 0.671585 -0.849333


%chk=000255079-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000255079

0 1
S 7.265766 0.091235 0.107002
N 2.039156 -0.544050 0.497681
C -2.340351 -0.048943 0.300975
C -3.873199 -0.057605 -0.075230
C -1.457071 0.801068 -0.653919
C -1.710258 -1.463603 0.433371
C 0.643409 -0.537111 -0.008347
C 0.009516 0.875102 -0.163453
C -0.240272 -1.404724 0.914145
C -4.419590 1.398795 -0.085908
C -4.133937 -0.697469 -1.466307
C -4.672574 -0.849616 0.998584
C 3.061789 0.091225 -0.358803
C 4.477617 -0.191144 0.191607
C 5.567408 0.473660 -0.664803
H -2.278915 0.427786 1.307582
H -1.858642 1.826854 -0.750495
H -1.473334 0.352998 -1.669128
H -1.746566 -1.976912 -0.549429
H -2.291411 -2.084475 1.139774
H 0.665491 -1.013523 -1.012496
H 0.609190 1.488797 -0.864301
H 0.043240 1.384367 0.824085
H -0.209454 -0.979234 1.941159
H 0.192788 -2.420603 0.973849
H -3.992523 1.996873 -0.910601
H -5.518409 1.395062 -0.215680
H -4.192829 1.916634 0.866027
H -3.803324 -1.751567 -1.501165
H -3.615466 -0.147805 -2.273178
H -5.216358 -0.681398 -1.695293
H -4.472198 -0.456438 2.014105
H -5.759177 -0.761282 0.809770
H -4.423497 -1.925679 0.993392
H 2.084609 -0.193684 1.466360
H 2.965919 -0.344558 -1.374070
H 2.933152 1.197325 -0.473635
H 4.549355 0.185794 1.232241
H 4.631309 -1.284981 0.232101
H 5.437517 1.569241 -0.691726
H 5.556415 0.077967 -1.694788
H 8.022508 0.799025 -0.814051


