%chk=000295598.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295598

0 1
S -3.094387 -0.704765 0.669908
S -1.941372 -3.178348 1.920449
O 3.192005 1.118718 2.460430
O 3.487000 2.448241 -0.136392
O -0.768322 -0.900379 -2.381590
O -3.924673 1.647331 -0.790419
N -1.155581 -2.049680 -0.398919
C 1.162877 -2.738930 0.292782
C -0.036713 -3.007620 -0.626125
C 1.760692 -1.363799 0.179786
C 2.154165 -0.698417 1.351160
C -1.389907 -0.973513 -1.347049
C 1.954181 -0.748793 -1.067380
C -1.956093 -2.080313 0.727487
C 2.749982 0.564137 1.266145
C -2.461193 -0.111781 -0.846676
C 2.556651 0.507066 -1.158371
C 2.963698 1.165963 0.006897
C -2.923694 1.007292 -1.439816
C -4.430823 2.882511 -1.425735
C 2.607919 2.413906 2.770430
C 4.883338 2.550396 0.258390
C -5.523504 3.321493 -0.477390
H 0.866216 -2.943436 1.347791
H 1.953593 -3.489799 0.068908
H 0.262108 -2.931715 -1.700135
H -0.415127 -4.044096 -0.456911
H 2.002139 -1.142365 2.334651
H 1.618552 -1.244468 -1.980691
H 2.713042 0.986061 -2.124193
H -2.550972 1.412907 -2.381453
H -3.595971 3.601007 -1.488145
H -4.805964 2.624009 -2.430234
H 3.178525 2.719792 3.653299
H 1.549022 2.278433 3.007730
H 2.742883 3.112691 1.936757
H 5.499112 1.974849 -0.437680
H 5.017259 2.201950 1.288819
H 5.073987 3.624178 0.165686
H -5.999073 4.250824 -0.815002
H -6.307764 2.555327 -0.381873
H -5.132515 3.491233 0.537472


%chk=000295598-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000295598

0 1
S -2.983984 -0.734436 1.102611
S -1.572021 -3.270855 2.181815
O 3.137086 1.157338 2.428969
O 3.621605 2.468295 -0.146161
O -1.028231 -0.926294 -2.345392
O -4.025312 1.696601 -0.625868
N -1.120724 -2.056631 -0.258272
C 1.271399 -2.820875 0.109845
C -0.066308 -3.022789 -0.648228
C 1.858470 -1.416306 0.036132
C 2.216552 -0.741482 1.228603
C -1.511175 -1.028087 -1.182905
C 2.076112 -0.758317 -1.202712
C -1.774939 -2.119322 0.965923
C 2.790678 0.547007 1.197787
C -2.537139 -0.171248 -0.570680
C 2.668600 0.521025 -1.243990
C 3.047494 1.176629 -0.052898
C -3.065360 0.911392 -1.215539
C -4.497964 2.875703 -1.415587
C 2.383623 2.397199 2.727699
C 5.004368 2.564551 0.377281
C -5.583821 3.556164 -0.591577
H 1.125201 -3.111164 1.164559
H 1.981742 -3.552915 -0.326186
H 0.063177 -2.889597 -1.736074
H -0.446175 -4.040764 -0.448085
H 2.042234 -1.200587 2.208102
H 1.775882 -1.238189 -2.140320
H 2.853509 1.030536 -2.195136
H -2.715330 1.160964 -2.227703
H -3.633071 3.544125 -1.590478
H -4.884346 2.512031 -2.387492
H 2.790981 2.765664 3.681677
H 1.307152 2.167781 2.841934
H 2.524803 3.148172 1.929180
H 5.683819 1.936927 -0.230245
H 5.050070 2.249504 1.435296
H 5.283246 3.624667 0.276207
H -5.964669 4.441435 -1.131916
H -6.426196 2.868074 -0.409875
H -5.185740 3.886176 0.382498


