%chk=000264064.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000264064

0 1
S -0.032786 2.674095 0.363278
O -1.745897 1.515517 -1.562626
N 0.958169 0.199244 0.477892
C 3.279120 -0.363820 -0.131251
C 3.519504 1.024177 -0.442713
C 1.981029 -0.735796 0.325017
C 2.495794 1.934252 -0.287758
C 1.231481 1.463130 0.175706
C 4.268883 -1.384817 -0.257571
C 1.693934 -2.102760 0.643961
C 4.859143 1.465366 -0.928252
C 3.975474 -2.690366 0.053571
C -1.509498 1.738849 0.796604
C 2.674298 -3.052311 0.508625
C -3.271960 0.235096 -0.277957
C -2.140643 1.199271 -0.465582
C -4.134027 0.297494 0.825100
C -3.465336 -0.748054 -1.260654
C -5.178948 -0.622445 0.946333
C -4.506493 -1.671271 -1.132767
C -5.363222 -1.608540 -0.029447
H 2.630526 2.989557 -0.518450
H 5.264782 -1.113553 -0.606339
H 0.689671 -2.352349 0.988170
H 5.127049 0.964974 -1.871481
H 4.906082 2.546943 -1.119710
H 5.647981 1.237000 -0.195943
H -1.266472 0.907272 1.498670
H -2.193426 2.420510 1.339813
H 4.730090 -3.468979 -0.042886
H 2.474402 -4.097195 0.745805
H -4.002263 1.062820 1.588530
H -2.797333 -0.779908 -2.125807
H -5.850629 -0.571705 1.801600
H -4.651315 -2.435609 -1.894744
H -6.176665 -2.326490 0.070061


%chk=000264064-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000264064

0 1
S -0.092930 2.521040 0.018294
O -1.995277 1.149932 -1.944497
N 1.143751 0.089184 0.394204
C 3.564342 -0.309604 0.009245
C 3.724169 1.076757 -0.385987
C 2.242964 -0.761315 0.393394
C 2.595829 1.897531 -0.375286
C 1.327042 1.357024 0.022879
C 4.643978 -1.247562 0.034478
C 2.049079 -2.121892 0.784760
C 5.074031 1.619425 -0.806212
C 4.431664 -2.575649 0.422069
C -1.471937 1.329929 0.443611
C 3.125663 -3.014672 0.799294
C -3.589056 0.132461 -0.449641
C -2.328495 0.901626 -0.753958
C -3.946626 -0.278343 0.863522
C -4.444149 -0.201548 -1.535794
C -5.135602 -1.006701 1.083425
C -5.632069 -0.924984 -1.314611
C -5.981666 -1.329290 -0.002982
H 2.665766 2.947915 -0.675464
H 5.649043 -0.921781 -0.254122
H 1.038409 -2.433916 1.065330
H 5.469282 1.075833 -1.684805
H 5.006690 2.687458 -1.070285
H 5.819825 1.514957 0.004152
H -0.950032 0.437799 0.855811
H -2.079229 1.797659 1.234754
H 5.267168 -3.283935 0.436368
H 2.969240 -4.056724 1.099307
H -3.299295 -0.045590 1.715393
H -4.147525 0.118183 -2.540308
H -5.402537 -1.323497 2.097560
H -6.285574 -1.175410 -2.157388
H -6.905438 -1.892701 0.170287


