%chk=000260964.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260964

0 1
S 3.309996 0.866300 1.858532
S -3.306566 -0.867315 1.859733
N 0.663762 0.140023 0.909218
N -0.661202 -0.139476 0.909739
C 1.265996 -1.802482 -0.577865
C -1.264619 1.802845 -0.577111
C 1.549819 -0.632150 0.337316
C -1.547716 0.632617 0.338433
C 2.942588 -0.296007 0.609950
C -2.940268 0.296438 0.612156
C 1.253242 -1.361329 -2.037428
C -1.253851 1.361662 -2.036681
C 4.097027 -0.746209 0.028781
C -4.095247 0.747589 0.032803
C 5.281365 -0.152382 0.594431
C -5.279095 0.153304 0.599003
C 5.017457 0.737801 1.593909
C -5.014287 -0.738157 1.597101
H 0.290234 -2.264892 -0.308258
H 2.017217 -2.603205 -0.419607
H -0.288366 2.264943 -0.308753
H -2.015361 2.603831 -0.417902
H 1.030292 -2.202670 -2.703315
H 0.485532 -0.585355 -2.215392
H 2.218201 -0.939187 -2.343056
H -0.486633 0.585413 -2.215568
H -2.219337 0.939838 -2.341089
H -1.031449 2.202907 -2.702870
H 4.148274 -1.469811 -0.772733
H -4.147228 1.472195 -0.767758
H 6.269749 -0.409575 0.239167
H -6.267810 0.411137 0.245127
H 5.719291 1.310683 2.175175
H -5.715606 -1.311622 2.178414


%chk=000260964-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000260964

0 1
S 3.314479 1.579273 0.572326
S -3.312333 -1.578915 0.574796
N 0.656356 0.254731 0.380055
N -0.654416 -0.254307 0.380570
C 1.342875 -2.147893 0.003942
C -1.341260 2.148357 0.005304
C 1.611313 -0.670079 0.245757
C -1.609488 0.670514 0.247171
C 2.982619 -0.188057 0.297303
C -2.980745 0.188467 0.299777
C 1.164756 -2.469183 -1.504998
C -1.164318 2.469806 -1.503742
C 4.180697 -0.896024 0.154699
C -4.178958 0.896435 0.158317
C 5.358876 -0.080447 0.261788
C -5.357028 0.080808 0.266234
C 5.075414 1.260614 0.485411
C -5.073347 -1.260293 0.489339
H 0.409142 -2.407277 0.532957
H 2.163218 -2.755004 0.425599
H -0.407118 2.407700 0.533617
H -2.161282 2.755413 0.427664
H 0.980840 -3.549349 -1.647455
H 0.300171 -1.918201 -1.913890
H 2.061540 -2.191469 -2.087882
H -0.300016 1.918914 -1.913354
H -2.061534 2.192098 -2.085963
H -0.980574 3.549996 -1.646234
H 4.214220 -1.973065 -0.025308
H -4.212659 1.973509 -0.021455
H 6.375236 -0.472277 0.177171
H -6.373467 0.472630 0.182539
H 5.770535 2.089882 0.608609
H -5.768345 -2.089604 0.612940


