%chk=000246952.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246952

0 1
O 0.849259 -0.682651 -1.940503
O 0.794675 1.137530 1.275170
N -1.814960 1.176802 -0.212932
C -1.131126 0.038613 -0.929959
C -3.310229 1.000645 -0.233748
C -1.467906 2.509621 -0.821415
C -3.966925 2.091458 0.627910
C -2.083139 3.636008 0.024750
C 0.411276 0.263414 -0.951117
C -3.606647 3.491316 0.116664
C -1.456575 -1.297177 -0.279953
C 1.126856 0.038490 0.410128
C 2.631411 0.071223 0.260394
C -1.484437 -2.440345 -1.094664
C -1.695167 -1.426901 1.096573
C -1.765157 -3.692056 -0.541395
C -1.977611 -2.680515 1.645635
C 3.324161 -1.115027 -0.024498
C 3.334270 1.274782 0.405085
C -2.016542 -3.814684 0.828781
C 4.712628 -1.089445 -0.178581
C 4.723547 1.293558 0.255059
C 5.413420 0.113636 -0.041257
H -1.447564 -0.009007 -2.012045
H -3.565223 0.001731 0.181327
H -3.721844 1.030079 -1.265718
H -1.805391 2.596583 -1.876247
H -0.357923 2.619865 -0.822692
H -3.634281 1.980929 1.679422
H -5.063100 1.949874 0.631339
H -1.811798 4.615249 -0.410320
H -1.643590 3.615054 1.042510
H 0.657368 1.289638 -1.320938
H -4.067561 3.666453 -0.873761
H -4.023523 4.263102 0.789829
H 0.795383 -0.907365 0.898609
H -1.261128 -2.352578 -2.158667
H -1.665349 -0.546582 1.740662
H 1.824153 -0.639827 -2.050075
H -0.194319 1.216143 1.356803
H -1.784552 -4.573768 -1.179537
H -2.164620 -2.772898 2.714135
H 2.783327 -2.056737 -0.117987
H 2.785771 2.185706 0.655840
H -2.237344 -4.789466 1.258215
H 5.250196 -2.009887 -0.399985
H 5.268790 2.228441 0.373013
H 6.495140 0.129872 -0.159157


%chk=000246952-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246952

0 1
O 0.932454 -1.083963 -1.803489
O 0.496359 1.079233 1.261709
N -1.675350 1.133975 -0.262120
C -1.091452 -0.074574 -0.977873
C -3.140097 1.003977 0.038037
C -1.460178 2.402976 -1.040045
C -3.631405 2.184699 0.898319
C -1.894895 3.635865 -0.222411
C 0.473588 0.027765 -0.967337
C -3.378139 3.535495 0.193681
C -1.555194 -1.407363 -0.388574
C 1.094766 0.007247 0.471494
C 2.605725 0.183614 0.393982
C -1.938194 -2.450085 -1.265771
C -1.573670 -1.654622 1.010581
C -2.333668 -3.711521 -0.766283
C -1.974975 -2.911270 1.512799
C 3.443065 -0.939619 0.163422
C 3.190072 1.469970 0.499765
C -2.356359 -3.946290 0.627109
C 4.840436 -0.775292 0.017507
C 4.586244 1.632860 0.360266
C 5.415527 0.513117 0.109877
H -1.390598 -0.052967 -2.051085
H -3.315351 0.054555 0.564547
H -3.717781 0.966498 -0.917640
H -2.036946 2.358480 -1.995135
H -0.393251 2.498112 -1.295614
H -3.099098 2.164939 1.869445
H -4.709289 2.049228 1.109903
H -1.717289 4.546015 -0.826779
H -1.253265 3.708974 0.677388
H 0.777246 0.988237 -1.432936
H -4.020584 3.605530 -0.708374
H -3.654847 4.378618 0.853937
H 0.877366 -0.987603 0.915873
H -1.906784 -2.277351 -2.347554
H -1.286357 -0.859381 1.709293
H 1.924026 -1.051568 -1.842389
H -0.471488 1.200146 0.907539
H -2.621976 -4.507132 -1.462506
H -1.986315 -3.082980 2.595129
H 3.006199 -1.946256 0.139105
H 2.536045 2.318433 0.724198
H -2.665854 -4.922084 1.018242
H 5.478061 -1.650060 -0.154593
H 5.030839 2.630672 0.452781
H 6.498732 0.641650 0.003283


