%chk=000280719.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000280719

0 1
S -4.503563 0.499177 0.307036
S -2.317544 0.242335 -1.701231
S 2.316792 -1.740644 0.299724
O 2.391384 -2.175585 1.672445
O 3.318077 -2.196032 -0.645826
N -0.277048 -1.823764 0.107228
N 0.861763 -2.349328 -0.428496
C -3.401884 -0.656348 -0.558338
C -2.491248 2.376044 0.019377
C -2.614119 -1.491325 0.435622
C -3.361762 1.693988 1.064876
C -1.480284 1.437165 -0.621124
C -1.471516 -2.225401 -0.232113
C -1.813566 -3.322946 -1.190664
C 2.159524 -0.030111 0.234839
C 1.667665 0.667794 1.343451
C 2.517086 0.666227 -0.925796
C 1.885772 2.757779 0.130844
C 1.529978 2.055738 1.295016
C 2.380373 2.052701 -0.981413
C 1.755833 4.242703 0.072359
H -4.059731 -1.295718 -1.200836
H -3.128636 2.846908 -0.762667
H -1.948534 3.221593 0.497269
H -2.221767 -0.863026 1.269364
H -3.280686 -2.229465 0.935672
H -2.751448 1.196491 1.841911
H -4.006654 2.429531 1.588033
H -0.767589 1.988708 -1.267069
H -0.864530 0.903469 0.131791
H -1.304806 -4.262566 -0.933072
H -2.888364 -3.543485 -1.212831
H -1.524394 -3.053025 -2.218553
H 0.844297 -3.145030 -1.076760
H 1.393646 0.122981 2.255398
H 2.912865 0.122890 -1.791879
H 1.155444 2.592617 2.164071
H 2.664180 2.589609 -1.884690
H 1.354191 4.587300 -0.891348
H 1.103687 4.647945 0.857556
H 2.740017 4.723404 0.196523


%chk=000280719-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000280719

0 1
S -5.045303 0.081958 0.397573
S -2.813623 0.243696 -1.818247
S 2.336871 -1.758070 0.452936
O 2.146755 -2.122991 2.027299
O 3.506111 -2.442596 -0.447643
N -0.383957 -1.733252 0.055217
N 0.762522 -2.145133 -0.593233
C -3.710034 -0.855685 -0.566450
C -3.189296 2.290370 0.154907
C -2.760123 -1.619035 0.396757
C -3.963101 1.434556 1.175308
C -2.100094 1.527453 -0.621523
C -1.556593 -2.230954 -0.290150
C -1.739388 -3.295942 -1.352325
C 2.385572 0.109001 0.288416
C 1.928458 0.876758 1.369086
C 2.903399 0.659760 -0.894692
C 2.505041 2.895533 0.071742
C 1.993923 2.283108 1.246018
C 2.956551 2.066425 -0.991446
C 2.598632 4.406237 -0.040179
H -4.281149 -1.556230 -1.199698
H -3.898463 2.751670 -0.557151
H -2.697686 3.115232 0.713870
H -2.386230 -0.942909 1.183408
H -3.360788 -2.405364 0.896638
H -3.281370 0.964157 1.905828
H -4.689835 2.049993 1.732562
H -1.532648 2.209035 -1.277503
H -1.384010 1.016566 0.046066
H -1.079239 -4.170985 -1.178512
H -2.777695 -3.663476 -1.376589
H -1.490203 -2.889789 -2.352018
H 0.858551 -3.141856 -0.891685
H 1.551699 0.387865 2.272857
H 3.259802 0.012451 -1.702056
H 1.646839 2.910623 2.074834
H 3.355655 2.526362 -1.902911
H 2.298142 4.757402 -1.043433
H 1.961145 4.910695 0.705651
H 3.638062 4.748658 0.126169


