%chk=000259789.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259789

0 1
S 1.078889 2.387485 -1.179628
S -1.032990 -2.473254 -1.213183
S 4.091559 -0.248790 0.821023
S -4.150190 0.182347 0.594115
O 2.673863 -0.771553 1.560357
O -2.774456 0.712771 1.403816
O 0.277481 2.902317 -0.077316
O 0.532328 2.443179 -2.518657
O -0.292908 -2.976607 -0.063686
O -0.414510 -2.542644 -2.519888
O 4.264584 -0.990061 -0.397340
O 4.062406 1.197203 0.775857
O -4.256915 0.911532 -0.639070
O -4.118849 -1.263998 0.564839
N 1.298888 0.707322 -0.857554
N -1.269451 -0.789908 -0.920812
C 0.749192 0.125823 0.382466
C -0.788724 -0.195868 0.341711
C 1.556157 -1.143331 0.737092
C -1.613641 1.076542 0.638664
C 2.656853 3.072303 -1.144481
C -2.610808 -3.157945 -1.256770
C 5.194306 -0.774744 2.054153
C -5.317921 0.720045 1.760555
H 0.912808 0.868053 1.220986
H -0.998452 -0.929693 1.177353
H 1.901432 -1.717793 -0.145644
H 0.987782 -1.841904 1.392915
H -1.910399 1.641556 -0.267502
H -1.081719 1.782212 1.317094
H 1.291096 0.053899 -1.655272
H -1.217300 -0.144611 -1.723458
H 3.187173 3.032675 -2.107066
H 3.347550 2.559081 -0.422996
H 2.675753 4.124087 -0.823995
H -3.088070 -3.128250 -2.247084
H -3.339510 -2.637465 -0.579213
H -2.647436 -4.206406 -0.927077
H 5.900536 -1.545617 1.705956
H 5.809138 0.040393 2.467209
H 4.681678 -1.223119 2.924064
H -4.852994 1.177119 2.652456
H -6.004136 1.487205 1.367073
H -5.954374 -0.091186 2.147741


%chk=000259789-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259789

0 1
S 1.139258 1.766095 -1.398935
S -1.087835 -1.865782 -1.439335
S 4.203066 -0.198460 0.890053
S -4.261395 0.147313 0.654950
O 2.840866 0.137121 2.172457
O -2.976055 -0.195815 2.012301
O 1.258470 3.008346 -0.361394
O -0.267068 1.624296 -2.254595
O -1.273646 -3.097633 -0.399462
O 0.366458 -1.739491 -2.213331
O 3.985206 -1.698832 0.318852
O 4.506124 1.036975 -0.112915
O -3.996618 1.643351 0.092117
O -4.522334 -1.088046 -0.360104
N 1.431219 0.226864 -0.404335
N -1.426754 -0.315814 -0.477296
C 0.706485 0.245524 0.884338
C -0.771966 -0.323277 0.847905
C 1.579119 -0.550582 1.877423
C -1.694840 0.482241 1.786596
C 2.612518 1.687790 -2.579500
C -2.492287 -1.789228 -2.701168
C 5.568644 -0.180183 2.205057
C -5.697688 0.147832 1.892564
H 0.694118 1.303742 1.218930
H -0.777745 -1.378563 1.192021
H 1.776158 -1.575096 1.499854
H 1.092003 -0.620721 2.869499
H -1.863334 1.506310 1.394203
H -1.264412 0.553909 2.804484
H 1.238580 -0.595383 -1.040610
H -1.199593 0.498814 -1.111951
H 2.437871 0.810328 -3.218055
H 3.484912 1.574331 -1.916684
H 2.593774 2.631256 -3.142102
H -2.273683 -0.922488 -3.340846
H -3.398599 -1.658066 -2.088970
H -2.452721 -2.740618 -3.249158
H 5.344265 -1.006778 2.890474
H 6.514013 -0.314990 1.661859
H 5.498995 0.800529 2.693396
H -5.665540 -0.831904 2.386716
H -5.502204 0.974322 2.586889
H -6.610109 0.290862 1.297614


