%chk=000289141.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289141

0 1
S -3.625756 -2.117090 -0.805012
N 0.041964 -0.048804 0.265939
N 1.223217 -0.677666 0.542414
C -1.348264 -2.115615 0.708281
C -1.108509 -0.660582 0.376851
C -2.318542 0.159519 0.131564
C -1.981703 -2.821400 -0.477253
C -3.479368 -0.413868 -0.407684
C -2.325914 1.533324 0.437819
C -4.624571 0.353393 -0.646243
C -3.465613 2.303813 0.204049
C -4.614300 1.715549 -0.338512
C 2.425693 0.008473 0.166415
C 3.612409 -0.750002 0.151763
C 4.831677 -0.114203 -0.123467
C 2.450711 1.389133 -0.104796
C 4.860772 1.262664 -0.391688
C 3.672720 1.999841 -0.381075
C 6.092855 -0.917121 -0.129809
H -0.414605 -2.633752 1.008191
H -2.001791 -2.180857 1.609191
H -1.354605 -2.736478 -1.385910
H -2.132394 -3.901251 -0.281694
H -1.428977 1.995306 0.856359
H -5.521224 -0.100662 -1.069959
H -3.460260 3.365927 0.443464
H -5.501537 2.319916 -0.521606
H 1.267594 -1.705224 0.544513
H 3.597741 -1.814933 0.359234
H 1.527092 1.966650 -0.098326
H 5.802761 1.758071 -0.607837
H 3.701137 3.069440 -0.591943
H 6.975962 -0.318430 -0.388486
H 6.284223 -1.362838 0.856989
H 6.039108 -1.741143 -0.855238


%chk=000289141-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000289141

0 1
S -3.823686 -2.166840 0.805516
N 0.048045 -0.017862 -0.038787
N 1.240054 -0.688070 0.030603
C -1.113770 -2.229748 0.023817
C -1.092386 -0.703668 -0.048363
C -2.338493 0.099570 -0.105085
C -2.469344 -2.867624 -0.303307
C -3.614494 -0.422411 0.268155
C -2.279535 1.469554 -0.502563
C -4.766256 0.399292 0.265907
C -3.421108 2.289197 -0.498021
C -4.673971 1.756379 -0.104788
C 2.464409 0.018610 0.047993
C 3.672105 -0.723583 0.107753
C 4.927991 -0.070982 0.128730
C 2.502562 1.437196 0.009064
C 4.959469 1.346005 0.086841
C 3.753006 2.083960 0.028559
C 6.212233 -0.881423 0.197132
H -0.370489 -2.638922 -0.699189
H -0.790866 -2.557600 1.035331
H -2.764796 -2.678927 -1.348865
H -2.457350 -3.953727 -0.117982
H -1.305027 1.868322 -0.798743
H -5.733111 -0.032839 0.545544
H -3.340703 3.337631 -0.804957
H -5.571255 2.384636 -0.103516
H 1.281404 -1.712560 0.092687
H 3.635463 -1.822063 0.137383
H 1.564688 1.995486 -0.029594
H 5.923178 1.867583 0.101421
H 3.789068 3.179068 -0.000279
H 7.099980 -0.226824 0.169951
H 6.263308 -1.478243 1.127540
H 6.289379 -1.589473 -0.649390


