%chk=000283530.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000283530

0 1
S 4.755813 -0.644487 1.918125
O 0.770166 1.775668 -2.001530
O 0.785298 -2.543286 1.356058
N 2.916557 -0.280582 -0.533539
N -0.061082 -0.210864 -1.240078
N -0.847416 -0.961053 1.374819
C 3.500987 0.951948 0.092098
C 3.882325 -1.428240 -0.534711
C 2.386108 0.008222 -1.898338
C -1.223985 0.404128 -0.637181
C 3.617051 0.733478 1.596567
C 4.008102 -1.943643 0.895270
C 0.994597 0.618498 -1.700286
C 0.156067 -1.606833 -0.798107
C -1.615906 0.014790 0.670307
C -1.960209 1.379022 -1.318685
C 0.108255 -1.757686 0.722167
C -3.089481 1.960210 -0.727232
C -2.751211 0.587665 1.257662
C -3.489225 1.558995 0.567822
C -3.854332 3.002029 -1.477503
C -4.692205 2.162385 1.217162
H 2.813209 1.809568 -0.104108
H 4.486276 1.232280 -0.342936
H 4.879466 -1.156006 -0.947784
H 3.481569 -2.240036 -1.182671
H 2.998592 0.731707 -2.485547
H 2.328141 -0.912165 -2.516807
H 4.022386 1.628224 2.104361
H 2.628573 0.515114 2.046504
H 3.011869 -2.231571 1.306503
H 4.655594 -2.836618 0.955016
H 1.124945 -2.013462 -1.166779
H -0.645451 -2.247491 -1.245449
H -1.626732 1.701134 -2.309866
H -0.971106 -1.050656 2.383238
H -3.059870 0.282662 2.255856
H -3.880199 3.952637 -0.925147
H -3.415671 3.219314 -2.461173
H -4.894214 2.690592 -1.649285
H -4.890699 1.750294 2.214884
H -4.575916 3.250076 1.335407
H -5.596737 1.995736 0.613916


%chk=000283530-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000283530

0 1
S 5.505276 -0.786964 1.514479
O 0.753962 1.784464 -2.018475
O 0.470842 -2.348988 2.042132
N 3.046505 -0.494145 -0.604207
N -0.000843 -0.017107 -0.721888
N -1.155976 -0.716408 1.703303
C 3.423183 0.669351 0.245639
C 4.195315 -1.380387 -0.937153
C 2.287979 -0.088194 -1.812527
C -1.272406 0.573208 -0.383702
C 3.916143 0.232809 1.631315
C 4.781168 -2.054315 0.311902
C 0.956288 0.637120 -1.515421
C 0.213795 -1.397712 -0.212486
C -1.853322 0.186580 0.856291
C -1.967151 1.499131 -1.196949
C -0.121957 -1.535956 1.276617
C -3.207581 2.049821 -0.799181
C -3.096706 0.724845 1.253051
C -3.784074 1.659257 0.448103
C -3.909842 3.052566 -1.696912
C -5.112178 2.229849 0.909422
H 2.525177 1.303653 0.372783
H 4.205373 1.294089 -0.249729
H 5.003282 -0.822382 -1.470847
H 3.823331 -2.168392 -1.622788
H 2.849304 0.618637 -2.463956
H 2.082512 -0.999589 -2.409947
H 4.168559 1.108954 2.251000
H 3.153113 -0.377648 2.143670
H 4.003509 -2.627798 0.844636
H 5.615928 -2.722185 0.042232
H 1.281892 -1.646221 -0.305098
H -0.409331 -2.118374 -0.781281
H -1.513127 1.816546 -2.136226
H -1.455071 -0.819724 2.677003
H -3.534041 0.411283 2.209443
H -4.040169 4.029070 -1.191164
H -3.336422 3.229812 -2.621658
H -4.921322 2.706719 -1.985285
H -5.404868 1.824902 1.892856
H -5.071242 3.332597 0.996280
H -5.924508 1.998924 0.193723


