%chk=000285996.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000285996

0 1
S -4.379739 -1.536973 -1.123215
O 0.487860 2.449221 0.547461
O 3.474841 -1.304317 1.743766
O 0.852204 3.222211 -1.550403
O 4.222637 -0.570132 -0.263441
O -1.969950 -0.395640 -2.334398
N -0.934935 0.394270 -0.461517
N -4.635633 -1.082098 1.449416
N -6.437449 -2.373583 0.505446
C 0.235648 0.864588 -1.222094
C 1.475067 -0.029267 -1.036679
C 1.892813 -0.208597 0.422833
C 0.561108 2.310630 -0.820413
C 3.314082 -0.687320 0.523722
C -2.001499 -0.234086 -1.122896
C -3.118963 -0.667311 -0.294920
C 0.788615 3.762905 1.124367
C 4.788594 -1.860202 2.070258
C 2.287022 3.966858 1.174778
C -3.427852 -0.528841 1.039178
C 4.990475 -3.169395 1.337038
C -5.270440 -1.670867 0.409931
H -0.033781 0.876822 -2.327942
H 2.322304 0.392162 -1.626738
H 1.268304 -1.021126 -1.494456
H 1.213765 -0.914166 0.948927
H 1.799594 0.753866 0.985975
H -0.900318 0.511628 0.546130
H 0.273399 4.533813 0.523303
H 0.323805 3.663718 2.121787
H 5.558741 -1.109313 1.819634
H 4.695215 -1.981706 3.164870
H -2.826889 -0.025417 1.795438
H 2.797832 3.141407 1.685504
H 2.714320 4.035837 0.161794
H 2.547434 4.894662 1.699286
H 4.143629 -3.851356 1.486438
H 5.088622 -3.006300 0.252715
H 5.898025 -3.683343 1.674801
H -6.967482 -2.595582 -0.322034
H -6.953526 -2.349560 1.377048


%chk=000285996-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000285996

0 1
S -3.941525 -1.945984 -1.091014
O 0.097545 2.893941 0.400531
O 3.884136 -1.108573 1.298202
O 1.570046 3.310409 -1.362677
O 3.446126 -1.920026 -0.847536
O -1.425812 -0.754593 -2.321289
N -0.811267 0.646683 -0.566496
N -4.337807 -1.098167 1.438521
N -5.997667 -2.637972 0.682271
C 0.329339 1.187097 -1.317856
C 1.564827 0.233327 -1.325102
C 2.108670 -0.053398 0.085625
C 0.737644 2.567060 -0.801006
C 3.189714 -1.121901 0.082236
C -1.641865 -0.302947 -1.146527
C -2.783575 -0.760489 -0.332613
C 0.453930 4.214309 1.016922
C 4.941723 -2.153217 1.472995
C 1.711058 4.089098 1.880363
C -3.186411 -0.473797 0.967488
C 4.333574 -3.456900 1.997867
C -4.858818 -1.896500 0.499277
H 0.023900 1.306051 -2.376194
H 2.347873 0.689367 -1.956860
H 1.255656 -0.707198 -1.811016
H 1.288402 -0.412589 0.739511
H 2.518798 0.851994 0.570133
H -1.046270 1.101734 0.317414
H 0.594259 4.945492 0.201995
H -0.438062 4.470199 1.610405
H 5.445478 -2.307978 0.502655
H 5.637564 -1.699002 2.196497
H -2.661113 0.199634 1.649191
H 1.590799 3.303740 2.646574
H 2.593070 3.856670 1.260632
H 1.899460 5.047907 2.397878
H 3.779174 -3.283484 2.936456
H 3.649240 -3.897055 1.253320
H 5.137249 -4.188912 2.201514
H -6.373202 -3.242276 -0.042465
H -6.468362 -2.573655 1.582878


