%chk=000208394.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208394

0 1
S 1.796381 0.102616 -0.703861
O 1.642781 -2.576936 -0.766945
N -1.570110 -0.743674 -0.525019
N -0.036847 -3.116517 0.677337
C 2.126727 1.731839 0.088571
C 0.668895 -0.742297 0.458400
C -0.690376 -0.132512 0.320468
C 2.852251 1.535312 1.406363
C 2.963312 2.465084 -0.947371
C 0.794685 -2.197936 0.013397
C -1.033919 1.032461 1.037997
C -2.294455 1.598853 0.836448
C -2.789412 -0.177682 -0.710207
C -3.188568 0.998028 -0.054223
H 1.160142 2.264045 0.248333
H 1.047975 -0.652916 1.507575
H 3.160471 2.497359 1.837459
H 2.234273 1.028927 2.156016
H 3.767960 0.937176 1.285863
H 3.223870 3.473383 -0.599626
H 2.432461 2.581295 -1.902952
H 3.910341 1.949784 -1.163930
H -0.331543 1.484954 1.733760
H -2.579036 2.504761 1.372743
H -3.455676 -0.697942 -1.409539
H -4.171009 1.425921 -0.235081
H -0.926876 -2.815228 1.045351
H -0.052199 -4.061957 0.311574


%chk=000208394-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000208394

0 1
S 1.309807 0.641792 -0.755467
O 1.761658 -1.853825 1.739004
N -1.792957 -0.756003 -0.414061
N 0.198285 -2.557368 0.153851
C 2.665620 1.623011 0.198069
C 0.333875 -0.155486 0.713224
C -1.141197 0.082879 0.455716
C 3.734300 0.688657 0.785519
C 3.238327 2.640291 -0.806285
C 0.819292 -1.607224 0.921276
C -1.811289 1.169836 1.074650
C -3.171973 1.400911 0.785269
C -3.105931 -0.521813 -0.691542
C -3.836611 0.543191 -0.122059
H 2.122958 2.153609 1.003627
H 0.655757 0.407367 1.603773
H 4.466708 1.279924 1.370905
H 3.292854 -0.080526 1.442502
H 4.277050 0.168622 -0.024528
H 4.028415 3.239084 -0.315285
H 2.460874 3.327689 -1.183119
H 3.697075 2.124130 -1.669765
H -1.266024 1.819921 1.766066
H -3.704692 2.233488 1.256542
H -3.579176 -1.215872 -1.394887
H -4.890126 0.688389 -0.378491
H -0.612936 -2.263919 -0.419087
H 0.512557 -3.524554 0.223484


