%chk=000236967.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236967

0 1
S -1.683815 0.856903 1.124337
N -3.879097 -0.501129 0.254526
N -0.288562 -0.677505 -0.439401
C -2.769796 -1.105656 -0.554256
C -1.527649 -0.439736 -0.079536
C 0.622923 0.183987 0.232902
C 2.057777 0.053269 -0.060761
C -4.465077 -1.492608 1.201967
C -4.933714 0.090979 -0.617335
C 0.039077 1.062931 1.108619
C 2.901215 1.172743 0.047253
C 2.596675 -1.186701 -0.445733
C 4.267291 1.047056 -0.216307
C 3.963503 -1.304251 -0.707002
C 4.801136 -0.190029 -0.590932
H -2.890263 -0.935353 -1.650868
H -2.681636 -2.211584 -0.437753
H -3.667915 -1.883890 1.856476
H -4.977513 -2.342157 0.728047
H -5.187133 -0.974025 1.854883
H -5.675628 0.601161 0.019887
H -5.466313 -0.627462 -1.256961
H -4.479748 0.865262 -1.258512
H 0.522553 1.791817 1.733273
H 2.490457 2.141034 0.327575
H 1.939889 -2.052811 -0.545656
H 4.916826 1.916326 -0.131511
H 4.376639 -2.266730 -1.003672
H 5.865697 -0.285040 -0.794548


%chk=000236967-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236967

0 1
S -1.748162 1.563318 0.710699
N -4.013371 -0.467414 0.109510
N -0.378607 -0.401723 -0.468814
C -2.867428 -0.633706 -0.807526
C -1.613920 0.002231 -0.263845
C 0.589546 0.460897 0.102897
C 2.024669 0.130749 -0.041922
C -3.908357 -1.311197 1.318807
C -5.320409 -0.600485 -0.563531
C 0.042479 1.554524 0.767978
C 3.044636 0.966603 0.490346
C 2.405185 -1.052883 -0.732175
C 4.404350 0.627237 0.337738
C 3.766449 -1.390602 -0.883478
C 4.773909 -0.553616 -0.349812
H -3.125005 -0.144553 -1.767790
H -2.628174 -1.699799 -1.041246
H -2.943720 -1.126709 1.822089
H -3.980572 -2.404243 1.093943
H -4.716358 -1.047180 2.023366
H -6.125217 -0.356410 0.152291
H -5.516579 -1.627185 -0.961927
H -5.384033 0.113912 -1.403407
H 0.559224 2.348253 1.302990
H 2.780806 1.886576 1.024355
H 1.616065 -1.690879 -1.141085
H 5.177351 1.283159 0.753938
H 4.041689 -2.306760 -1.418106
H 5.831354 -0.815314 -0.467283


