%chk=000272324.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272324

0 1
S -2.665349 0.595196 -1.926491
O -1.869899 1.200036 -2.971147
O -3.841298 -0.184276 -2.232326
O 7.779454 -0.657410 -0.435503
O 6.878982 1.270869 -0.820187
N -1.516047 -0.432757 -1.127415
N 0.590624 -1.592524 0.244052
N 6.818649 0.092240 -0.508670
C -3.045228 1.767156 -0.730355
C -1.784355 -1.475593 -0.228014
C -2.320538 2.964985 -0.674556
C -4.084433 1.542858 0.181031
C -0.714577 -2.083305 0.509168
C -3.657407 3.697201 1.213129
C -2.620652 3.924948 0.290003
C -4.390084 2.498180 1.148928
C -3.103804 -1.942832 -0.020262
C -1.011966 -3.100504 1.439901
C -3.359625 -2.945737 0.904364
C -3.989990 4.727011 2.238271
C -2.318046 -3.523559 1.647828
C 2.978916 -1.520200 0.411959
C 1.662452 -2.108531 0.759539
C 4.122966 -2.337385 0.487076
C 3.102816 -0.173432 0.028422
C 5.487018 -0.467361 -0.193642
C 5.378056 -1.815803 0.182501
C 4.354881 0.357797 -0.276057
H -0.508939 -0.289294 -1.338935
H -1.518580 3.154601 -1.398525
H -4.668114 0.616633 0.132608
H -2.053833 4.854033 0.325508
H -5.199757 2.316280 1.853794
H -3.930927 -1.556349 -0.627444
H -0.201066 -3.559449 2.007417
H -4.383111 -3.295912 1.049572
H -4.405205 4.290562 3.157844
H -3.117112 5.325765 2.535409
H -4.743524 5.432091 1.850772
H -2.535135 -4.304125 2.372677
H 1.710699 -2.969531 1.445400
H 4.031730 -3.384887 0.776142
H 2.209844 0.453691 -0.036813
H 6.276684 -2.440710 0.232842
H 4.465029 1.405333 -0.578016


%chk=000272324-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000272324

0 1
S -1.855464 0.931857 -0.907165
O -0.558074 1.678818 -1.556965
O -2.802271 -0.089065 -1.754119
O 8.083760 -0.996655 -1.016917
O 6.990659 0.761864 -1.977620
N -1.102829 0.028146 0.689850
N 0.863726 -1.815625 0.438871
N 7.007708 -0.338289 -1.300524
C -2.976422 2.236574 -0.151952
C -1.447849 -1.327804 0.859129
C -2.395623 3.425019 0.318266
C -4.355063 1.978852 -0.111903
C -0.400457 -2.319431 0.806727
C -4.658523 4.189963 0.940927
C -3.254817 4.400335 0.868136
C -5.192202 2.972363 0.442912
C -2.780250 -1.725196 1.146806
C -0.719382 -3.680965 1.068195
C -3.075488 -3.079023 1.384135
C -5.569747 5.262380 1.508433
C -2.045575 -4.058009 1.347427
C 3.264557 -1.898144 0.103160
C 1.998200 -2.454151 0.599410
C 4.482267 -2.582669 0.381757
C 3.300204 -0.691447 -0.657504
C 5.714657 -0.878121 -0.817445
C 5.713004 -2.078916 -0.073169
C 4.521664 -0.177215 -1.118538
H -0.078829 0.091295 0.477138
H -1.316295 3.588655 0.241618
H -4.756977 1.047740 -0.525058
H -2.829179 5.337760 1.244088
H -6.273634 2.799700 0.483489
H -3.566060 -0.965158 1.191331
H 0.061545 -4.447831 1.014525
H -4.105626 -3.381047 1.600287
H -6.535864 4.843402 1.837513
H -5.105878 5.774585 2.369652
H -5.786610 6.035868 0.746617
H -2.287510 -5.110641 1.528087
H 2.069741 -3.427315 1.126227
H 4.458476 -3.512465 0.962375
H 2.358308 -0.182245 -0.882789
H 6.659610 -2.585320 0.131369
H 4.574610 0.743572 -1.704992


