%chk=000187634.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187634

0 1
S 0.697054 -0.453347 1.818088
O 2.022604 2.663488 -0.311894
O -0.260849 -1.436919 2.301211
O 1.681697 0.065928 2.750253
N -0.163956 0.924148 1.228086
C 0.758543 3.061882 0.330239
C 0.774545 2.461003 -1.051877
C 0.399372 2.250723 1.574898
C 0.596602 4.550024 0.488246
C -1.644839 0.905319 1.041894
C -1.993345 -0.071869 -0.074519
C -2.407749 0.612224 2.337520
C 1.481659 -1.070007 0.411526
C -2.117394 0.420862 -1.383546
C -2.215328 -1.433583 0.169550
C 2.500533 -0.336257 -0.204023
C 1.104997 -2.317163 -0.100485
C -2.458728 -0.438082 -2.431401
C -2.559557 -2.290541 -0.879536
C 3.149564 -0.854763 -1.329765
C 1.753042 -2.835451 -1.224202
C -2.682141 -1.795925 -2.181357
C 2.777340 -2.103298 -1.836826
H 0.513208 1.413809 -1.208560
H 0.671460 3.089463 -1.931513
H -0.302208 2.832806 2.215446
H 1.335088 2.136146 2.190077
H 1.019089 4.908978 1.436904
H 1.125802 5.097036 -0.306720
H -0.458446 4.846372 0.452002
H -1.945686 1.937961 0.698512
H -3.489185 0.596498 2.163523
H -2.202332 1.359755 3.109623
H -2.139650 -0.370507 2.765952
H -1.950806 1.477161 -1.587418
H -2.107494 -1.831333 1.186836
H 2.789563 0.654684 0.179278
H 0.301131 -2.887631 0.379829
H -2.552968 -0.048949 -3.443343
H -2.734965 -3.346146 -0.678541
H 3.943447 -0.282027 -1.807238
H 1.461638 -3.805610 -1.622049
H -2.951654 -2.463774 -2.996828
H 3.285002 -2.508387 -2.712754


%chk=000187634-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000187634

0 1
S 0.747198 -0.351829 1.696363
O 2.026163 2.865238 -0.170244
O -0.202088 -1.493953 2.382081
O 1.911834 0.353668 2.599237
N -0.253844 1.129776 0.907831
C 0.789238 3.387844 0.541749
C 0.746491 3.132880 -0.933456
C 0.161309 2.403882 1.539288
C 0.925865 4.807176 1.069609
C -1.746284 0.878549 0.842220
C -2.067133 -0.251782 -0.146869
C -2.452686 0.757261 2.214902
C 1.538782 -1.117054 0.165276
C -1.898875 -0.012241 -1.535715
C -2.550702 -1.517637 0.266982
C 2.483272 -0.355787 -0.542838
C 1.171024 -2.431582 -0.156781
C -2.194245 -1.009502 -2.488939
C -2.853061 -2.518204 -0.684749
C 3.099378 -0.974256 -1.655738
C 1.802014 -3.027005 -1.273693
C -2.674191 -2.270854 -2.064506
C 2.762595 -2.301406 -2.016495
H 0.258389 2.220359 -1.293203
H 0.796681 3.981094 -1.628620
H -0.691142 2.902078 2.043539
H 0.925405 2.190101 2.318359
H 1.435919 4.813964 2.050003
H 1.520013 5.420393 0.371701
H -0.067231 5.278472 1.193244
H -2.099740 1.819443 0.364916
H -3.546812 0.702880 2.072789
H -2.240153 1.639643 2.844929
H -2.116385 -0.138707 2.760225
H -1.536169 0.966988 -1.872066
H -2.678993 -1.732183 1.331071
H 2.709420 0.677665 -0.255517
H 0.424347 -2.959570 0.444463
H -2.058136 -0.803723 -3.556556
H -3.227023 -3.491146 -0.346252
H 3.840733 -0.415975 -2.237028
H 1.542634 -4.052206 -1.557481
H -2.910357 -3.047568 -2.800684
H 3.250245 -2.770485 -2.878253


