%chk=000242765.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000242765

0 1
S 2.302003 -1.727344 -0.161435
O 1.762687 -2.457288 0.965575
O 3.307040 -2.340284 -1.003166
O -4.988302 -0.885233 0.727673
O -4.359680 1.109543 1.253151
N 1.001284 -1.417763 -1.273781
N -4.154953 0.007868 0.770903
C -0.303458 -1.070424 -0.771764
C -0.666325 0.324472 -0.772064
C -1.932825 0.725818 -0.259331
C -1.195394 -2.042230 -0.324751
C -2.817116 -0.300602 0.213948
C -2.464817 -1.635641 0.164697
C 0.215029 1.324969 -1.296330
C -2.268420 2.116448 -0.262473
C -0.847927 -3.491145 -0.306512
C 2.793005 -0.156236 0.337922
C -0.137732 2.650134 -1.291510
C -1.396734 3.050715 -0.761600
C 2.210872 0.434820 1.464786
C 3.784974 0.521881 -0.380208
C 2.612833 1.711707 1.867562
C 4.187326 1.797684 0.022630
C 3.599008 2.392192 1.145311
H 0.954639 -2.015960 -2.114223
H -3.169729 -2.403434 0.513253
H 1.174901 1.009014 -1.711520
H -3.233957 2.433764 0.148755
H -0.514397 -3.858179 -1.285730
H -0.025262 -3.681693 0.416980
H -1.685613 -4.130372 0.002660
H 0.531624 3.409595 -1.693193
H -1.657278 4.109595 -0.762481
H 1.446510 -0.101874 2.038342
H 4.253537 0.050680 -1.251962
H 2.158068 2.174297 2.743378
H 4.960732 2.326365 -0.533399
H 3.913051 3.388942 1.459907


%chk=000242765-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000242765

0 1
S 2.071784 -1.359445 0.525321
O 1.174709 -1.347873 1.885117
O 2.994645 -2.639546 0.101712
O -5.426525 -1.544725 -0.019241
O -5.144164 0.533940 0.856148
N 0.833728 -1.160887 -1.118282
N -4.684801 -0.520664 0.263032
C -0.525685 -1.004040 -0.773885
C -1.016983 0.346085 -0.563191
C -2.400393 0.581354 -0.185779
C -1.402622 -2.119662 -0.660549
C -3.247778 -0.586274 -0.102507
C -2.761784 -1.878636 -0.351096
C -0.140412 1.461374 -0.744165
C -2.830322 1.935958 0.019549
C -0.899960 -3.539571 -0.829404
C 3.159736 0.179336 0.526918
C -0.589296 2.767516 -0.541776
C -1.940490 3.000322 -0.150318
C 2.793820 1.240776 1.370109
C 4.308621 0.167211 -0.280247
C 3.642417 2.371643 1.394658
C 5.140349 1.310379 -0.241647
C 4.805694 2.406139 0.589293
H 1.038474 -2.108065 -1.498195
H -3.461502 -2.714479 -0.267186
H 0.879109 1.261551 -1.084164
H -3.860151 2.124710 0.320803
H -0.491855 -3.723887 -1.842560
H -0.099075 -3.773124 -0.102346
H -1.714886 -4.263696 -0.671960
H 0.089534 3.612906 -0.696888
H -2.292450 4.025131 0.009456
H 1.893608 1.176831 1.989817
H 4.554100 -0.706154 -0.892372
H 3.394978 3.216998 2.044706
H 6.047200 1.339676 -0.854203
H 5.457834 3.285690 0.615319


