%chk=000295821.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295821

0 1
S 2.063895 -3.333325 0.521217
O 0.868652 3.245271 -0.146885
N -0.516507 0.994368 -0.040074
N 0.740724 -1.017916 0.196761
N 3.171380 -0.954508 0.297525
N 3.106872 3.265466 -0.324450
C 0.700944 0.367798 0.050421
C -1.814831 0.373819 -0.005429
C 1.931414 1.118394 0.006806
C -2.854097 1.128056 0.578133
C -2.075086 -0.884100 -0.569759
C 3.130154 0.382208 0.144749
C -4.147658 0.607956 0.594977
C -3.378620 -1.387493 -0.538849
C 1.949478 -1.599800 0.314824
C 1.908662 2.577929 -0.154535
C -4.414358 -0.649113 0.039544
C 0.353786 -3.891464 0.513110
H -0.509539 2.048196 -0.080272
H -2.653401 2.104560 1.016958
H -1.273625 -1.467882 -1.024594
H 4.107451 0.885996 0.137327
H -4.954549 1.185313 1.046073
H -3.585659 -2.364369 -0.975091
H -5.426137 -1.048511 0.057914
H 4.004169 2.825364 -0.395443
H 3.081473 4.268189 -0.444778
H -0.092643 -3.827943 -0.487269
H -0.281423 -3.299786 1.190606
H 0.337979 -4.937475 0.845583


%chk=000295821-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000295821

0 1
S 2.281028 -3.437451 0.167600
O 0.713105 3.198938 -0.027272
N -0.505488 0.872802 0.052532
N 0.832666 -1.105386 0.103123
N 3.270013 -0.962364 0.083406
N 3.009154 3.314937 -0.056188
C 0.722721 0.267721 0.061539
C -1.822093 0.343198 0.077126
C 1.925556 1.094720 0.027140
C -2.875471 1.302291 0.065865
C -2.141208 -1.041203 0.109389
C 3.153333 0.390276 0.041372
C -4.220018 0.885691 0.086171
C -3.494524 -1.442639 0.129187
C 2.073823 -1.638494 0.112111
C 1.843266 2.577234 -0.019591
C -4.540778 -0.492454 0.117912
C 0.492079 -4.007214 0.198021
H -0.409481 1.917543 0.022035
H -2.631814 2.371468 0.040994
H -1.330577 -1.768712 0.118280
H 4.113395 0.920669 0.019004
H -5.017494 1.636788 0.077160
H -3.731165 -2.512738 0.153729
H -5.586518 -0.817352 0.133523
H 3.939238 2.904932 -0.054782
H 2.914858 4.329334 -0.086859
H -0.022184 -3.673057 -0.714378
H -0.012285 -3.607492 1.089308
H 0.535763 -5.106787 0.237645


