%chk=000189762.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189762

0 1
S -0.112628 -2.480058 2.282188
P 3.402644 -1.512412 -0.187104
O 0.565053 2.489196 -1.172976
O -0.106699 3.861041 1.736620
O 2.290647 3.187854 1.504260
O 2.964447 0.053322 -0.020734
O 3.788208 -1.615139 -1.786171
O 1.991167 -2.356793 -0.339170
O 4.352048 -1.946258 0.831147
N -1.510814 1.540860 -0.589210
N -3.243117 0.476501 -1.682293
N -0.761676 -0.382926 0.851383
N -2.140932 -2.393573 0.523864
N -3.944814 -2.480160 -1.005703
C -0.007836 2.566135 1.178523
C 1.471753 2.106890 1.036095
C -0.551155 2.620113 -0.281290
C 1.746820 2.000799 -0.479074
C 1.986978 0.564337 -0.967036
C -1.550591 0.231289 -0.094781
C -2.562636 1.617751 -1.574535
C -2.644691 -0.414106 -0.773758
C -2.928636 -1.770364 -0.430104
C -1.128609 -1.670722 1.087690
C -0.804342 -4.135394 2.414804
H -0.612269 1.923970 1.858442
H 1.694752 1.167557 1.585079
H -1.008696 3.607386 -0.541555
H 2.558889 2.696787 -0.793787
H 2.414554 0.555501 -1.988799
H 1.060128 -0.042517 -0.930974
H 0.730307 4.384745 1.555924
H 2.615209 2.999086 2.413334
H -2.740234 2.528067 -2.132730
H -4.535633 -2.048697 -1.702120
H -4.126564 -3.435223 -0.740522
H 3.324699 -2.322971 -2.309412
H 1.536383 -2.697406 0.481779
H -0.180778 -4.705492 3.116618
H -0.825209 -4.657744 1.448109
H -1.836526 -4.116730 2.793183


%chk=000189762-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189762

0 1
S -0.042397 -2.621123 1.942556
P 3.791897 -1.348185 0.288350
O 0.422071 2.127533 -1.397433
O 0.252553 4.215052 0.971307
O 2.194235 2.627664 1.748235
O 3.245373 0.267799 0.073904
O 4.651625 -1.557732 -1.182614
O 2.467899 -2.380743 -0.040902
O 4.556627 -1.529797 1.659094
N -1.773773 1.570689 -0.570046
N -3.779796 0.672272 -1.258890
N -0.858080 -0.426168 0.625683
N -2.397230 -2.334652 0.548157
N -4.484092 -2.249799 -0.560336
C -0.070930 2.795277 0.888542
C 1.224720 1.946528 0.895632
C -0.677658 2.556501 -0.515601
C 1.656572 1.920882 -0.592756
C 2.264080 0.578001 -1.009233
C -1.798261 0.252419 -0.094938
C -2.986496 1.754586 -1.266727
C -3.044093 -0.278217 -0.528669
C -3.325487 -1.632802 -0.184892
C -1.250620 -1.699016 0.902710
C -0.696824 -4.378444 1.807578
H -0.767005 2.505570 1.697749
H 1.004885 0.930350 1.257309
H -1.084534 3.507812 -0.899663
H 2.349272 2.759965 -0.790601
H 2.796719 0.627093 -1.972797
H 1.479048 -0.198018 -1.041181
H 1.108466 4.276999 1.480656
H 3.014135 2.073418 1.790291
H -3.222924 2.699205 -1.752501
H -5.174072 -1.733712 -1.103424
H -4.647406 -3.218497 -0.294371
H 4.901777 -2.492002 -1.394064
H 1.752354 -2.491514 0.669869
H -0.008368 -4.995592 2.405212
H -0.700436 -4.695646 0.755780
H -1.714228 -4.409454 2.218228


