%chk=000179430.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179430

0 1
S -2.927964 -0.301413 -0.751257
S -1.172299 2.172812 -0.546946
O 0.871703 0.365427 -0.254932
O 2.034364 -1.639045 -0.641646
N 3.032369 0.253859 0.319009
N -0.318018 -0.362269 -0.414472
C -1.337082 0.419786 -0.555803
C 4.430442 -0.146490 0.045648
C 2.006786 -0.501803 -0.254766
C -2.636073 -2.076938 -0.753689
C -2.833886 2.804302 -0.830781
H 2.875239 1.245761 0.494588
H 4.845789 0.344272 -0.849768
H 4.496989 -1.242769 -0.102086
H 5.052684 0.111640 0.920369
H -3.597497 -2.578695 -0.921505
H -2.213748 -2.426022 0.199668
H -1.935383 -2.379422 -1.546560
H -3.251130 2.474685 -1.791303
H -2.766575 3.902071 -0.852036
H -3.532010 2.525450 -0.030833


%chk=000179430-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000179430

0 1
S -3.017799 -0.264140 -0.822466
S -1.203676 2.288262 -0.545833
O 0.906283 0.389684 -0.334762
O 2.014191 -1.737001 -0.216584
N 3.143385 0.324637 -0.057654
N -0.349163 -0.368906 -0.501596
C -1.357143 0.466595 -0.604706
C 4.492903 -0.220441 0.109101
C 2.044633 -0.492448 -0.201743
C -2.574192 -2.098550 -0.812971
C -2.996229 2.842515 -0.743239
H 2.989349 1.333143 -0.068211
H 5.160881 0.103056 -0.710519
H 4.419584 -1.319353 0.090728
H 4.934081 0.088402 1.074828
H -3.533434 -2.622793 -0.944034
H -2.101731 -2.356708 0.144330
H -1.882403 -2.312339 -1.638829
H -3.401160 2.510200 -1.710041
H -2.952232 3.942326 -0.713004
H -3.611428 2.469059 0.088104


