%chk=000214843.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214843

0 1
S 2.637802 1.989303 -0.570187
S 4.048325 -0.965091 0.660186
O -4.099769 1.803287 0.320326
O -1.736940 -1.970994 1.483242
O -0.281237 0.917824 -1.408043
O 1.578313 -2.990429 0.243484
N -3.102974 -0.857055 0.041176
N 0.312335 -1.211465 -0.629853
C -4.022167 -0.494310 1.157478
C -3.252001 0.027195 -1.143327
C -0.973190 -1.898678 -0.801694
C -1.926133 -1.549606 0.354885
C -3.896993 0.997890 1.499840
C -3.160373 1.507916 -0.731633
C 1.939025 0.435050 -0.447602
C 2.482389 -0.702696 0.035535
C 0.527577 0.183854 -0.906365
C 1.484530 -1.833201 -0.038972
C 4.112393 1.804534 0.489219
C 4.905196 0.564529 0.154815
H -5.059354 -0.733437 0.832123
H -3.796940 -1.124769 2.050675
H -2.475964 -0.198539 -1.910220
H -4.247098 -0.182595 -1.599057
H -1.401998 -1.648358 -1.800929
H -0.803901 -3.007352 -0.778065
H -4.708638 1.344630 2.164049
H -2.915454 1.242346 1.941997
H -2.139774 1.782113 -0.404485
H -3.488681 2.185357 -1.539939
H 3.807344 1.824927 1.556861
H 4.716892 2.723116 0.321878
H 5.152780 0.511561 -0.926265
H 5.877077 0.553941 0.696166


%chk=000214843-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000214843

0 1
S 2.796971 2.105515 -0.302805
S 4.323945 -1.203446 0.395248
O -4.648021 1.695616 0.138022
O -1.594675 -1.712250 1.623023
O -0.224725 1.118219 -0.981916
O 1.696245 -3.058022 -0.021496
N -3.061389 -0.718702 0.108720
N 0.395987 -1.132756 -0.549754
C -4.055266 -0.473529 1.185156
C -3.390584 -0.023376 -1.158179
C -0.911548 -1.772999 -0.705883
C -1.880500 -1.371382 0.431449
C -4.248762 1.039466 1.396468
C -3.611302 1.482890 -0.884801
C 2.082355 0.461378 -0.319804
C 2.642502 -0.758996 -0.032227
C 0.634647 0.257977 -0.658574
C 1.585872 -1.819824 -0.168668
C 4.417510 1.678880 0.594717
C 5.153960 0.463985 0.013019
H -5.018276 -0.929699 0.883050
H -3.687140 -0.960001 2.103324
H -2.574057 -0.126414 -1.886606
H -4.315973 -0.463370 -1.580166
H -1.303135 -1.588350 -1.718349
H -0.735062 -2.857903 -0.590752
H -5.068965 1.236311 2.105963
H -3.309155 1.492775 1.777540
H -2.652101 1.939391 -0.567172
H -3.982553 1.988539 -1.791346
H 4.187525 1.540037 1.662396
H 5.028595 2.588891 0.469586
H 5.269191 0.545523 -1.078855
H 6.150285 0.366425 0.476973


