%chk=000207110.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207110

0 1
S 0.424345 1.738621 -2.098110
S -0.871239 -1.496905 1.514475
S 0.338458 3.502926 0.152476
O 0.330929 -0.608082 -3.225947
N 4.299981 0.493161 1.276099
N 1.683029 1.199617 0.270582
N -0.954176 -0.506957 -1.307142
C 3.950504 0.288274 -0.167760
C 3.569550 1.687496 1.815755
C 2.431824 0.046510 -0.307722
C 2.054812 1.439415 1.700969
C 5.773792 0.663064 1.436987
C 0.896960 2.049167 -0.397869
C -1.661035 0.333125 -0.362227
C -1.127780 -1.941696 -1.179266
C -0.083107 0.004491 -2.277690
C -1.671328 -0.023078 0.996454
C -1.117499 -2.514376 0.104739
C -2.367783 1.466274 -0.794805
C -1.286520 -2.758169 -2.309091
C -2.323529 0.771223 1.937707
C -1.273725 -3.888567 0.272454
C -3.006450 2.269112 0.155056
C -1.428178 -4.138006 -2.136238
C -2.977051 1.932932 1.513503
C -1.422629 -4.702630 -0.856251
H 4.489121 -0.616575 -0.528551
H 4.261092 1.133395 -0.820569
H 3.841117 2.640009 1.309904
H 3.837153 1.802859 2.889339
H 2.196584 -0.124453 -1.379129
H 2.133372 -0.875955 0.249297
H 1.763166 0.530936 2.281443
H 1.489394 2.298921 2.130564
H 6.204623 1.528225 0.911447
H 6.281482 -0.248389 1.080372
H 6.007644 0.757527 2.510424
H -2.412819 1.734072 -1.851132
H -1.278046 -2.322073 -3.311390
H -2.328210 0.493176 2.992378
H -1.279288 -4.329297 1.270744
H -3.526936 3.171078 -0.170484
H -1.545139 -4.777546 -3.012003
H -3.468788 2.575551 2.242844
H -1.537677 -5.779004 -0.735536


%chk=000207110-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000207110

0 1
S 0.504573 1.801169 -2.213130
S -0.634074 -1.455967 1.562042
S 0.466485 3.687706 0.172845
O 0.284547 -0.680861 -3.324271
N 4.320181 0.510219 1.272165
N 1.725475 1.245743 0.230581
N -0.911581 -0.507663 -1.306693
C 4.005958 0.356534 -0.165747
C 3.560010 1.639057 1.859607
C 2.493648 0.127489 -0.380826
C 2.049116 1.407855 1.674822
C 5.770274 0.604145 1.530369
C 0.964414 2.172529 -0.428274
C -1.622669 0.336327 -0.365693
C -1.113079 -1.944531 -1.177308
C -0.086477 -0.018112 -2.329050
C -1.595326 0.009920 1.010998
C -1.014528 -2.523426 0.113384
C -2.422013 1.414448 -0.811892
C -1.409819 -2.764855 -2.290775
C -2.302381 0.791071 1.948307
C -1.190621 -3.911595 0.292611
C -3.112500 2.209429 0.124809
C -1.566183 -4.156383 -2.112859
C -3.045960 1.906496 1.504642
C -1.453056 -4.732294 -0.826755
H 4.550183 -0.521993 -0.559428
H 4.322973 1.250413 -0.762381
H 3.837451 2.621113 1.399907
H 3.783093 1.695233 2.941248
H 2.285166 0.066674 -1.458071
H 2.184012 -0.814172 0.108324
H 1.754286 0.471170 2.184176
H 1.468834 2.256841 2.068353
H 6.247686 1.502043 1.063783
H 6.276407 -0.295724 1.137622
H 5.949801 0.648509 2.619410
H -2.473024 1.643076 -1.879798
H -1.489324 -2.317983 -3.283233
H -2.279246 0.521327 3.009067
H -1.127866 -4.341254 1.297548
H -3.700267 3.064200 -0.223410
H -1.781173 -4.788162 -2.980751
H -3.582588 2.524840 2.231448
H -1.580817 -5.811202 -0.690624


