%chk=000185214.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185214

0 1
S -1.859178 -1.738011 0.065205
O -4.022211 -0.224573 0.072689
N -2.057945 0.928171 -0.246314
C 1.620829 1.308755 0.898810
C 0.101789 0.998336 0.994938
C -0.578985 0.930944 -0.380984
C 2.315808 0.315348 -0.034116
C 2.249859 1.152021 2.299411
C 1.798908 2.769112 0.441776
C 3.224670 0.725932 -1.018491
C 2.064534 -1.060764 0.117264
C -2.758390 2.242677 -0.356262
C -2.814396 -0.203023 -0.042300
C 3.857696 -0.212919 -1.841193
C 2.694843 -1.996599 -0.703769
C -2.985914 2.633555 -1.814129
C 3.594574 -1.575490 -1.689222
C -3.192487 -2.969421 0.303662
C -2.885989 -3.766696 1.549440
H -0.387093 1.765898 1.625062
H -0.055057 0.043757 1.536579
H -0.281217 1.806542 -1.003616
H -0.233880 0.034842 -0.949515
H 1.806396 1.845263 3.020697
H 3.327553 1.349820 2.270622
H 2.120855 0.138102 2.693293
H 2.853554 3.066475 0.439660
H 1.275456 3.458988 1.112707
H 1.402937 2.929897 -0.566745
H 3.456610 1.780321 -1.156215
H 1.365928 -1.405802 0.880038
H -3.739224 2.168843 0.174944
H -2.155758 3.013032 0.171902
H 4.559329 0.124098 -2.602137
H 2.484075 -3.057238 -0.577359
H -3.605326 1.888428 -2.333237
H -3.506499 3.595492 -1.885063
H -2.048222 2.718844 -2.373928
H 4.084767 -2.304555 -2.329999
H -3.231098 -3.603984 -0.601275
H -4.172534 -2.444116 0.378298
H -1.919914 -4.285216 1.491034
H -2.861650 -3.134360 2.448596
H -3.653901 -4.534827 1.720540


%chk=000185214-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000185214

0 1
S -1.654291 -1.881614 -0.210005
O -3.991856 -0.417614 0.025821
N -2.052941 0.857997 -0.235519
C 1.694253 1.318772 0.853958
C 0.159626 1.018629 0.948330
C -0.585238 0.962061 -0.406957
C 2.408529 0.303144 -0.071579
C 2.290136 1.174687 2.288859
C 1.903295 2.787103 0.395010
C 3.336852 0.703134 -1.067553
C 2.176566 -1.091099 0.090844
C -2.834116 2.121985 -0.172490
C -2.741166 -0.329456 -0.123459
C 4.011184 -0.248943 -1.867845
C 2.843173 -2.044604 -0.707083
C -3.281285 2.609113 -1.566473
C 3.769776 -1.628686 -1.691454
C -3.032801 -3.147289 0.091495
C -3.280988 -3.403234 1.583421
H -0.301039 1.805321 1.580092
H -0.007998 0.059433 1.472643
H -0.389942 1.878317 -0.994095
H -0.217834 0.112827 -1.009565
H 1.791502 1.872058 2.988972
H 3.372331 1.399073 2.285709
H 2.158378 0.147748 2.673769
H 2.965956 3.083130 0.462922
H 1.330554 3.467063 1.052613
H 1.572433 2.958629 -0.645405
H 3.544096 1.765319 -1.230686
H 1.454117 -1.442954 0.836578
H -3.717600 1.941337 0.462608
H -2.200857 2.881638 0.323489
H 4.723242 0.090393 -2.629258
H 2.635664 -3.111075 -0.563568
H -3.953131 1.867948 -2.031547
H -3.826589 3.567025 -1.480715
H -2.415920 2.766010 -2.236076
H 4.289371 -2.367308 -2.312097
H -2.700558 -4.050760 -0.446873
H -3.929178 -2.730554 -0.396268
H -2.369105 -3.761333 2.093092
H -3.621926 -2.478025 2.078297
H -4.070576 -4.169450 1.709346


