%chk=000201365.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201365

0 1
S -2.128620 2.525978 0.273972
O 0.407173 -0.531839 -0.856773
O -3.581811 2.462700 0.293461
O -1.401112 2.341604 1.512264
N -4.863695 -2.132362 0.080917
C 4.020099 -0.903893 -0.003888
C 2.698345 -0.275591 -0.458113
C 5.191334 0.069016 -0.194614
C 1.534729 -1.244882 -0.258334
C 6.518953 -0.556060 0.256708
C -1.879296 -0.011878 -0.612582
C -1.531625 1.400421 -0.951544
C -0.861480 -0.996403 -0.543595
C -3.198487 -0.398439 -0.383255
C 7.688124 0.408036 0.069546
C -1.156502 -2.328703 -0.240409
C -3.505198 -1.740355 -0.069709
C -1.673375 4.088054 -0.392176
C -2.478890 -2.702087 0.003029
H 3.950796 -1.202117 1.060871
H 4.211376 -1.836529 -0.569856
H 2.751966 0.021690 -1.524953
H 2.499302 0.661718 0.099848
H 5.004580 1.001350 0.372870
H 5.262183 0.373044 -1.256730
H 1.321253 -1.441610 0.805359
H 1.664241 -2.190220 -0.810872
H 6.450902 -0.857836 1.320451
H 6.709207 -1.488193 -0.310594
H -0.422527 1.478716 -1.073632
H -1.930877 1.632320 -1.961887
H -4.000833 0.347965 -0.430139
H 8.631206 -0.045875 0.394476
H 7.809008 0.698470 -0.980244
H 7.550634 1.327535 0.650037
H -0.370271 -3.077953 -0.199211
H -1.860773 4.903558 0.324809
H -0.610787 4.173455 -0.643415
H -2.243174 4.363557 -1.287649
H -2.711587 -3.738370 0.234994
H -5.499952 -1.385040 0.331757
H -5.015739 -2.947748 0.658704


%chk=000201365-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000201365

0 1
S -2.314263 2.840986 -0.438795
O 0.295634 -0.054535 -0.504936
O -1.726293 4.181545 -1.172749
O -3.898954 2.748080 -0.029437
N -4.852246 -2.336652 0.109663
C 4.048912 -0.593140 -0.054037
C 2.714052 0.077729 -0.453318
C 5.281590 0.263184 -0.421871
C 1.506598 -0.789128 -0.090854
C 6.621103 -0.399002 -0.026369
C -2.080288 -0.020593 -0.897264
C -1.902949 1.259416 -1.621684
C -0.949996 -0.697520 -0.342964
C -3.371654 -0.575343 -0.731717
C 7.848462 0.460829 -0.397794
C -1.133420 -1.930892 0.321631
C -3.570082 -1.804376 -0.046823
C -1.296345 2.557337 1.160239
C -2.425829 -2.477283 0.467872
H 4.055226 -0.790310 1.038577
H 4.131965 -1.582440 -0.551097
H 2.700755 0.275192 -1.542302
H 2.620167 1.058447 0.052394
H 5.202816 1.253607 0.072824
H 5.279486 0.460433 -1.513993
H 1.470282 -0.980230 1.002631
H 1.542843 -1.764971 -0.619166
H 6.622497 -0.595642 1.065378
H 6.698257 -1.388992 -0.520813
H -0.875125 1.480708 -1.937819
H -2.642071 1.455750 -2.413167
H -4.231604 -0.026359 -1.132456
H 8.792776 -0.033170 -0.104306
H 7.888212 0.645307 -1.487913
H 7.810695 1.444739 0.106757
H -0.281011 -2.476180 0.736523
H -1.473874 3.460421 1.760835
H -1.696060 1.652802 1.637140
H -0.246837 2.447688 0.855875
H -2.547679 -3.434043 0.989929
H -5.668129 -1.824368 -0.211386
H -4.998819 -3.203826 0.616660


