%chk=000214686.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214686

0 1
S 0.130792 -2.158973 -0.710329
O -2.599480 2.884088 0.546759
O -2.908034 1.698076 -1.324216
N 0.077199 0.170298 0.433023
C 2.422303 -0.581270 -0.133855
C 3.012413 -0.301927 1.266535
C 2.814082 0.540768 -1.121963
C 4.536908 -0.154950 1.189334
C 4.338938 0.686483 -1.194278
C 4.941879 0.941842 0.194312
C 0.935340 -0.688185 -0.056080
C -2.393881 0.550243 0.820494
C -1.256564 -0.284455 0.314687
C -1.425785 -1.511758 -0.273647
C -3.668714 -0.314735 0.946518
C -2.717704 -2.195658 -0.490802
C -3.880421 -1.202037 -0.289165
C -2.651178 1.694178 -0.145596
H 2.852731 -1.546296 -0.508588
H 2.738791 -1.115291 1.962955
H 2.561545 0.622600 1.681858
H 2.355656 1.497286 -0.798202
H 2.400566 0.326943 -2.124709
H 4.995844 -1.118000 0.894385
H 4.939220 0.080212 2.192866
H 4.601009 1.516943 -1.876966
H 4.785721 -0.224554 -1.636455
H 4.606007 1.927937 0.570290
H 6.043663 0.999237 0.123001
H -2.123864 0.981485 1.825363
H -4.552418 0.331352 1.108901
H -3.579211 -0.945144 1.853973
H -2.775337 -2.633938 -1.510026
H -2.816938 -3.050368 0.214101
H -3.969551 -0.556571 -1.191527
H -4.834618 -1.752215 -0.203454
H -2.740909 3.677253 -0.034296


%chk=000214686-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000214686

0 1
S 0.131402 -2.309912 -0.700821
O -2.929677 2.924038 0.506568
O -2.650971 1.699966 -1.444879
N 0.097960 0.144357 0.337455
C 2.450268 -0.596824 -0.189580
C 3.052291 -0.404865 1.234995
C 2.847566 0.594652 -1.112802
C 4.586124 -0.216231 1.177714
C 4.382613 0.778458 -1.161261
C 4.978463 0.961292 0.254413
C 0.953105 -0.749219 -0.120663
C -2.356352 0.593554 0.771458
C -1.235694 -0.292365 0.278040
C -1.446032 -1.559504 -0.242885
C -3.662965 -0.248019 0.958889
C -2.784680 -2.232310 -0.403600
C -3.921082 -1.185756 -0.243800
C -2.629054 1.744943 -0.196462
H 2.877439 -1.524979 -0.622729
H 2.794102 -1.275535 1.868002
H 2.576599 0.482996 1.694733
H 2.365084 1.511520 -0.722503
H 2.445448 0.426220 -2.129984
H 5.058643 -1.147913 0.801948
H 4.978413 -0.050267 2.199893
H 4.632005 1.649082 -1.798408
H 4.845029 -0.110120 -1.639977
H 4.597963 1.908155 0.690111
H 6.080510 1.052774 0.197250
H -2.071679 1.046816 1.736791
H -4.521572 0.429882 1.117491
H -3.547576 -0.848463 1.882235
H -2.862930 -2.722253 -1.392304
H -2.897691 -3.034257 0.354964
H -3.996108 -0.585223 -1.169105
H -4.884913 -1.710752 -0.108866
H -3.136052 3.646958 -0.147123


