%chk=000253953.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253953

0 1
S 2.020901 -2.045447 -0.897663
S -2.020909 -2.045438 0.897659
N 0.921813 -0.946338 1.259462
N -0.921820 -0.946341 -1.259474
C 0.669906 -2.103426 0.374615
C -0.669916 -2.103425 -0.374620
C 1.808489 0.007911 0.705035
C -1.808501 0.007909 -0.705053
C 2.539037 -0.441120 -0.423156
C -2.539048 -0.441116 0.423141
C 2.058988 1.279091 1.238891
C -2.059004 1.279084 -1.238919
C 3.522327 0.334989 -1.009458
C -3.522341 0.334995 1.009436
C 3.052273 2.062576 0.639476
C -3.052292 2.062570 -0.639511
C 3.775905 1.604968 -0.467236
C -3.775923 1.604968 0.467204
H 0.781603 -3.041349 0.980300
H -0.781617 -3.041350 -0.980301
H 0.115316 -0.599988 1.784657
H -0.115316 -0.599986 -1.784656
H 1.509366 1.642907 2.101655
H -1.509383 1.642895 -2.101685
H 4.087389 -0.022034 -1.869494
H -4.087402 -0.022024 1.869475
H 3.263789 3.052115 1.047122
H -3.263812 3.052104 -1.047165
H 4.542903 2.234698 -0.911744
H -4.542924 2.234699 0.911706


%chk=000253953-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000253953

0 1
S 2.168922 -2.232102 -0.773024
S -2.168932 -2.232099 0.773021
N 0.854691 -0.996409 1.223190
N -0.854702 -0.996417 -1.223201
C 0.656675 -2.200292 0.420452
C -0.656686 -2.200295 -0.420456
C 1.701722 -0.012066 0.698394
C -1.701735 -0.012071 -0.698412
C 2.505568 -0.461979 -0.386633
C -2.505581 -0.461978 0.386617
C 1.838648 1.317545 1.159584
C -1.838662 1.317536 -1.159611
C 3.442437 0.373696 -1.008883
C -3.442451 0.373700 1.008861
C 2.785699 2.165393 0.535578
C -2.785715 2.165387 -0.535611
C 3.584322 1.706962 -0.536758
C -3.584338 1.706962 0.536727
H 0.698451 -3.120030 1.031911
H -0.698461 -3.120037 -1.031909
H 0.172514 -0.786610 1.952162
H -0.172526 -0.786623 -1.952175
H 1.215584 1.685694 1.981746
H -1.215599 1.685681 -1.981775
H 4.056914 0.009990 -1.838943
H -4.056928 0.009998 1.838923
H 2.893944 3.195833 0.891696
H -2.893961 3.195825 -0.891737
H 4.313139 2.373951 -1.008062
H -4.313156 2.373953 1.008026


