%chk=000267975.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267975

0 1
S -2.752838 0.579063 2.520254
P -1.840123 0.034738 0.935636
O -2.160560 0.788384 -0.491398
O -2.182274 -1.523031 0.572762
N 0.552303 -0.363397 0.201685
N -0.125901 0.234157 1.232333
C 4.688597 -0.391588 -0.209224
C 3.704650 -0.488108 -1.382601
C 4.025451 0.259681 1.011715
C 2.432635 -1.252837 -0.988380
C 2.757168 -0.499079 1.431522
C 1.819993 -0.659505 0.259982
C -1.730884 2.172017 -0.652418
C -2.014634 -2.006105 -0.792879
C -2.691946 3.125677 0.027890
C -3.243458 -1.668307 -1.615316
H 5.059799 -1.400122 0.055946
H 5.578827 0.192071 -0.510405
H 4.186902 -0.986831 -2.244105
H 3.432186 0.528729 -1.728410
H 3.767125 1.312388 0.781729
H 4.736779 0.294720 1.858144
H 2.667652 -2.320104 -0.797100
H 1.710598 -1.244835 -1.831193
H 2.276421 0.026530 2.279356
H 3.026920 -1.505919 1.814606
H 0.251583 0.220341 2.202477
H -0.683523 2.299966 -0.322079
H -1.775798 2.256897 -1.759045
H -1.079822 -1.623349 -1.241650
H -1.923480 -3.095994 -0.604643
H -2.621693 4.133338 -0.396919
H -3.734334 2.791134 -0.086489
H -2.516216 3.215195 1.110161
H -3.282081 -2.253762 -2.539654
H -4.164701 -1.871077 -1.050103
H -3.272421 -0.602379 -1.893089


%chk=000267975-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000267975

0 1
S -2.578656 0.684651 2.862855
P -1.875442 -0.040931 1.064222
O -2.121657 0.807785 -0.434501
O -2.534749 -1.559840 0.607732
N 0.605571 -0.611540 0.076164
N -0.132127 -0.154818 1.172365
C 4.752085 -0.135000 -0.166775
C 3.822577 -0.322494 -1.388974
C 3.966167 0.378721 1.062482
C 2.639425 -1.271533 -1.050369
C 2.776587 -0.562945 1.415827
C 1.904064 -0.801141 0.191128
C -1.528176 2.165305 -0.603695
C -2.392978 -2.101461 -0.789387
C -2.482484 3.259465 -0.116618
C -3.663421 -1.826479 -1.592143
H 5.229783 -1.105298 0.082796
H 5.569598 0.569795 -0.411392
H 4.390751 -0.729142 -2.247048
H 3.420363 0.662005 -1.701423
H 3.572564 1.392451 0.849323
H 4.635070 0.467039 1.939475
H 3.046427 -2.289229 -0.869978
H 1.926360 -1.338923 -1.889761
H 2.218908 -0.141115 2.273063
H 3.185017 -1.538565 1.751751
H 0.264570 -0.066833 2.117969
H -0.551354 2.206781 -0.083713
H -1.350972 2.231132 -1.690815
H -1.494689 -1.670946 -1.264710
H -2.239221 -3.181124 -0.617659
H -2.050321 4.255161 -0.333329
H -3.454749 3.183234 -0.632843
H -2.657102 3.181432 0.969980
H -3.600530 -2.329500 -2.576605
H -4.550123 -2.213992 -1.061670
H -3.788236 -0.743409 -1.754627


