%chk=000270415.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270415

0 1
S -2.098478 -1.744830 -0.513006
S 2.103255 -1.810938 -0.069818
O -1.799797 -0.748292 -1.537396
O -2.877862 -2.907900 -0.891408
O 1.802040 -1.193063 1.218261
O 2.885409 -3.032205 -0.080695
N -3.164347 1.486422 0.761899
N 3.158661 1.661187 -0.250040
C -2.891180 -0.973643 0.866658
C 2.894365 -0.638962 -1.131504
C -4.364368 -0.663130 0.539030
C 4.366147 -0.444087 -0.719291
C -2.256624 0.393712 1.231727
C 2.255386 0.771607 -1.044687
C -0.547864 -2.314277 0.148361
C 0.554123 -2.143716 -0.879417
C -4.526855 0.866912 0.698111
C 4.523302 1.057626 -0.383280
C -2.735555 2.080365 -0.548642
C 2.726253 1.806771 1.180341
C -1.644477 3.119371 -0.294229
C 1.631877 2.869591 1.266794
H -2.857931 -1.640767 1.758736
H 2.864324 -0.988428 -2.189307
H -4.658942 -0.988612 -0.476646
H -5.040444 -1.204245 1.225044
H 4.661071 -1.074712 0.140715
H 5.044698 -0.736818 -1.540507
H -1.227110 0.522077 0.845082
H -2.193227 0.488535 2.339682
H 1.224959 0.767481 -0.639642
H 2.192987 1.213321 -2.065266
H -0.289862 -1.792561 1.104546
H -0.620446 -3.382625 0.452995
H 0.629835 -3.058240 -1.509762
H 0.293958 -1.344414 -1.618669
H -5.147285 1.301422 -0.107284
H -5.031676 1.109354 1.658573
H 5.141097 1.215350 0.519971
H 5.028524 1.594384 -1.215591
H -3.613131 2.578058 -1.015731
H -2.380874 1.313692 -1.279714
H 3.601562 2.132874 1.783263
H 2.373500 0.846507 1.629237
H -0.716548 2.665580 0.092563
H -1.969546 3.859948 0.448333
H -1.391543 3.652926 -1.216346
H 1.955098 3.808527 0.798316
H 0.705784 2.559404 0.754234
H 1.376358 3.082159 2.310103


%chk=000270415-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270415

0 1
S -1.724065 -1.298375 -0.784558
S 1.730210 -1.469035 0.353013
O -0.668266 -0.415276 -1.700733
O -3.062401 -1.917545 -1.506908
O 0.679084 -0.928785 1.509730
O 3.080958 -2.270050 0.832345
N -3.434735 1.813344 0.066531
N 3.419222 1.771671 0.499040
C -2.269641 -0.186681 0.825068
C 2.249534 0.099404 -0.830001
C -3.767310 -0.402467 1.074814
C 3.743531 -0.012888 -1.156389
C -2.094049 1.310937 0.448643
C 2.073230 1.397776 0.004344
C -0.696904 -2.859884 -0.170547
C 0.708217 -2.770940 -0.711496
C -4.356279 1.054100 0.959487
C 4.324599 1.343875 -0.605801
C -3.775565 1.682835 -1.388094
C 3.797916 1.192903 1.829902
C -2.880635 2.557523 -2.281455
C 2.905144 1.708434 2.970769
H -1.539394 -0.565178 1.557161
H 1.508224 -0.034069 -1.633144
H -4.199592 -1.061589 0.294925
H -3.954278 -0.866876 2.057934
H 4.192894 -0.874636 -0.622765
H 3.916706 -0.150445 -2.237230
H -1.339947 1.473686 -0.338264
H -1.746603 1.828397 1.365959
H 1.334791 1.294068 0.815746
H 1.702505 2.174348 -0.695429
H -0.748800 -2.832670 0.929136
H -1.273451 -3.695966 -0.598972
H 1.289507 -3.695233 -0.560347
H 0.758149 -2.407367 -1.749506
H -5.384495 1.066540 0.563000
H -4.363042 1.528925 1.959577
H 5.362299 1.247554 -0.247334
H 4.302771 2.107161 -1.407449
H -4.824315 2.020076 -1.486352
H -3.739129 0.626312 -1.746121
H 4.840575 1.512486 2.014391
H 3.794541 0.076544 1.830939
H -1.845584 2.173989 -2.323046
H -2.866011 3.597937 -1.911571
H -3.269334 2.554716 -3.316108
H 2.851062 2.811233 2.949487
H 1.882867 1.294524 2.908491
H 3.323891 1.393358 3.943881


