%chk=000184563.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184563

0 1
S 1.371832 -1.884255 -0.000568
O -4.154993 0.392153 -0.000513
O 5.219983 -0.264619 0.000119
O 3.672520 -1.796210 -0.000077
O -3.306316 -1.734324 -0.000239
N -1.940155 0.215694 -0.000256
N -0.352547 -1.612653 -0.000541
N 4.059142 -0.616220 0.000064
C 0.531311 0.598556 -0.000052
C 1.702152 -0.189614 -0.000116
C -0.635385 -0.324380 -0.000297
C 2.981026 0.370207 0.000110
C 0.669613 1.987699 0.000242
C 3.115630 1.763918 0.000356
C 1.955715 2.552738 0.000422
C -3.131961 -0.545917 -0.000305
C -5.519962 -0.168256 -0.000604
C -6.402044 1.059671 -0.000738
H -0.206521 2.637777 0.000314
H 4.109757 2.220260 0.000529
H 2.057468 3.639503 0.000642
H -2.032296 1.235055 -0.000296
H -5.623904 -0.791636 -0.905788
H -5.624067 -0.791557 0.904617
H -7.463967 0.782767 -0.000906
H -6.217854 1.688922 0.881226
H -6.217576 1.688922 -0.882645


%chk=000184563-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000184563

0 1
S 1.382409 -2.081614 -0.000047
O -4.138292 0.453034 -0.000108
O 5.370363 0.158507 -0.000048
O 4.105038 -1.748384 -0.000950
O -3.358579 -1.774559 -0.000171
N -1.915253 0.124523 0.000312
N -0.427020 -1.762247 -0.000308
N 4.235958 -0.455041 -0.000631
C 0.548787 0.444354 0.000269
C 1.750616 -0.326583 -0.000052
C -0.632190 -0.438892 0.000131
C 2.998326 0.335591 -0.000168
C 0.619159 1.857397 0.000565
C 3.070233 1.744059 0.000157
C 1.876457 2.500195 0.000528
C -3.146083 -0.548835 0.000283
C -5.543674 -0.050745 -0.000718
C -6.449670 1.175824 -0.001146
H -0.290708 2.469445 0.000807
H 4.054946 2.219476 0.000085
H 1.928970 3.592751 0.000748
H -1.992395 1.142828 0.000461
H -5.685803 -0.682305 -0.896150
H -5.686584 -0.682258 0.894623
H -7.507410 0.855902 -0.001596
H -6.275889 1.795915 0.894835
H -6.275110 1.795864 -0.897010


