%chk=000270930.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270930

0 1
S 3.153223 0.320440 -0.002558
N -1.837391 0.414796 -0.002770
N 0.146829 1.595083 0.001155
N -0.844633 -1.917072 -0.010020
N 1.601826 -1.870184 -0.009609
N -3.158411 0.068121 -0.004098
C 0.426909 0.217629 -0.003144
C -0.802912 -0.548797 -0.005713
C 1.631542 -0.520025 -0.005303
C 4.392301 -1.016886 -0.006731
C 5.699458 -0.298263 -0.004364
C -1.178570 1.706566 0.001358
C 6.318355 0.037671 1.210826
C 6.318642 0.045151 -1.217314
C -5.504597 0.539613 -0.003108
C 0.375198 -2.507575 -0.011755
C -4.093670 0.978079 -0.001444
C 7.544908 0.706571 1.209314
C 7.545195 0.714027 -1.211392
C 8.160645 1.045162 0.000065
C -6.509717 1.525139 -0.000097
C -5.861940 -0.819212 -0.007569
C -7.853748 1.149586 -0.001547
C -7.210426 -1.185746 -0.008985
C -8.206450 -0.205141 -0.005983
H 4.255780 -1.672409 -0.890990
H 4.255674 -1.678012 0.873330
H -1.737542 2.632238 0.004239
H 5.841773 -0.219109 2.155871
H 5.842283 -0.205800 -2.164036
H 0.401584 -3.610555 -0.015253
H -3.943727 2.068970 0.002017
H 8.021306 0.965804 2.153654
H 8.021817 0.979071 -2.154004
H 9.115929 1.566351 0.001784
H -6.245791 2.581386 0.003360
H -5.083830 -1.588556 -0.009925
H -8.630470 1.913183 0.000786
H -7.483058 -2.240838 -0.012449
H -9.256694 -0.493956 -0.007098


%chk=000270930-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270930

0 1
S 3.143876 0.644684 -0.002672
N -1.904969 0.480486 -0.003329
N 0.004202 1.764140 0.001137
N -0.850875 -1.782485 -0.011278
N 1.603307 -1.648440 -0.010791
N -3.228109 0.027385 -0.004660
C 0.345279 0.395521 -0.003693
C -0.824596 -0.424804 -0.006521
C 1.592227 -0.282991 -0.006022
C 4.394112 -0.818268 -0.006980
C 5.795389 -0.260245 -0.004289
C -1.335957 1.780312 0.001166
C 6.465875 0.002114 1.218783
C 6.467696 0.009259 -1.224800
C -5.600350 0.472510 -0.003290
C 0.404922 -2.317291 -0.013158
C -4.200563 0.915439 -0.002414
C 7.780491 0.518193 1.222657
C 7.782319 0.525337 -1.223671
C 8.442780 0.781132 0.000744
C -6.632442 1.450962 -0.000843
C -5.947501 -0.909573 -0.006454
C -7.987873 1.059697 -0.001529
C -7.300793 -1.294229 -0.007113
C -8.325422 -0.313365 -0.004649
H 4.164535 -1.413513 -0.903169
H 4.163483 -1.419571 0.884889
H -1.932259 2.688546 0.004492
H 5.953382 -0.198697 2.167288
H 5.956646 -0.185989 -2.175243
H 0.466857 -3.409171 -0.016969
H -4.036159 2.008266 0.000352
H 8.287304 0.713550 2.174224
H 8.290564 0.726274 -2.173310
H 9.463247 1.180222 0.002667
H -6.370841 2.516793 0.001607
H -5.143508 -1.652348 -0.008322
H -8.776643 1.819480 0.000371
H -7.564666 -2.357355 -0.009543
H -9.377367 -0.619470 -0.005164


