%chk=000249790.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249790

0 1
O -0.056323 -0.500482 -0.539543
O -1.207861 0.441672 1.166274
N -4.204589 -1.699186 -0.035415
C 3.293787 0.901740 0.555723
C 1.843598 0.898214 0.029925
C 1.211397 -0.478076 0.230850
C 4.108539 -0.223704 -0.114949
C 2.009402 -1.615830 -0.407933
C 3.454050 -1.593544 0.105747
C 3.947539 2.264835 0.311959
C -1.187929 -0.010686 0.049669
C -2.322592 -0.146437 -0.967450
C -2.870538 1.249584 -1.344822
C -3.548427 1.963747 -0.183936
C -3.367728 -1.011496 -0.435270
H 3.268868 0.713052 1.658212
H 1.243838 1.670026 0.549751
H 1.822372 1.169233 -1.043104
H 0.961067 -0.673474 1.295488
H 5.139237 -0.230687 0.285257
H 4.205534 -0.023484 -1.198902
H 1.988301 -1.511545 -1.511620
H 1.530179 -2.589008 -0.191497
H 4.041787 -2.378411 -0.407939
H 3.476282 -1.854812 1.181942
H 4.004303 2.507741 -0.754801
H 3.386834 3.069898 0.800510
H 4.968724 2.293975 0.708168
H -1.902044 -0.630534 -1.901258
H -2.035148 1.865934 -1.736497
H -3.585558 1.132904 -2.185776
H -3.815637 2.992754 -0.449319
H -4.469516 1.455801 0.130006
H -2.897551 2.010487 0.704148


%chk=000249790-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249790

0 1
O -0.199133 -0.667988 -0.563923
O -1.223460 -0.175900 1.481043
N -4.774195 -0.764721 0.859455
C 3.109642 0.905788 0.689829
C 1.658058 0.837104 0.139627
C 1.167472 -0.618599 0.078291
C 4.043606 0.005765 -0.160080
C 2.075477 -1.508251 -0.777562
C 3.527867 -1.450808 -0.239692
C 3.609712 2.364838 0.742677
C -1.292005 -0.413545 0.257466
C -2.568955 -0.444507 -0.603470
C -2.670040 0.851672 -1.487376
C -2.755845 2.155845 -0.671153
C -3.773462 -0.624699 0.227092
H 3.100513 0.503383 1.726401
H 0.981058 1.435298 0.777297
H 1.634841 1.268296 -0.882020
H 1.059821 -1.022025 1.104053
H 5.066410 0.023758 0.263830
H 4.112614 0.428626 -1.184618
H 2.048152 -1.146768 -1.824214
H 1.696387 -2.546707 -0.775493
H 4.185701 -2.057116 -0.890321
H 3.566611 -1.910886 0.769045
H 3.628377 2.810688 -0.270617
H 2.955297 2.991924 1.376101
H 4.634484 2.420285 1.154477
H -2.483588 -1.310158 -1.288323
H -1.784594 0.861160 -2.148553
H -3.563819 0.746796 -2.129771
H -2.859775 3.022473 -1.347839
H -3.627267 2.146504 0.007477
H -1.851764 2.312677 -0.055536


