%chk=000108220.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000108220

0 1
I 6.057592 -0.019988 -0.324731
O -0.218975 -1.847736 -0.460347
O -0.980962 -2.432950 1.577961
N -2.958116 -0.196585 -0.397149
C -2.522856 0.139354 1.003397
C -2.547347 1.048701 -1.141964
C -0.973469 -0.074170 1.013961
C -0.286034 0.906347 0.027450
C -1.017110 0.923261 -1.332118
C -2.894517 1.634695 1.217512
C -2.925550 2.235943 -0.205404
C 1.202951 0.650867 -0.076689
C -4.409104 -0.506227 -0.503821
C -0.744801 -1.556420 0.773486
C 2.048504 1.190284 0.908498
C 1.765618 -0.091700 -1.124497
C 3.431680 0.997921 0.843838
C 3.148683 -0.285758 -1.199722
C 3.963857 0.264873 -0.214420
C -0.039739 -3.259444 -0.764742
H -2.998146 -0.525339 1.756938
H -3.052127 1.119572 -2.126931
H -0.588125 0.134594 2.045482
H -0.404647 1.934230 0.472081
H -0.636498 1.744233 -1.961475
H -0.810681 -0.027639 -1.873609
H -2.180155 2.153997 1.872468
H -3.877523 1.718982 1.708323
H -3.925419 2.624466 -0.453099
H -2.230271 3.081005 -0.313987
H -4.620681 -1.417516 0.080637
H -4.643659 -0.736561 -1.555994
H -5.085504 0.290581 -0.162776
H 1.631200 1.764414 1.734315
H 1.113512 -0.544772 -1.875990
H 4.076708 1.420160 1.615627
H 3.572426 -0.864225 -2.021618
H 0.679387 -3.242601 -1.588188
H -1.008677 -3.665471 -1.070388
H 0.348876 -3.796477 0.108181


%chk=000108220-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000108220

0 1
I 6.187463 0.069123 -0.327761
O -0.145596 -1.956460 -0.338504
O -1.219826 -2.419706 1.664518
N -3.035618 -0.175163 -0.376051
C -2.538661 0.188362 0.986607
C -2.578539 1.004268 -1.181596
C -0.995978 -0.075438 0.988183
C -0.291947 0.860338 -0.049022
C -1.051420 0.856033 -1.400536
C -2.881952 1.712024 1.163972
C -2.938816 2.257840 -0.302631
C 1.222064 0.645628 -0.144410
C -4.492521 -0.431994 -0.437741
C -0.808892 -1.584000 0.823555
C 2.025567 0.830411 1.011086
C 1.875633 0.306503 -1.353695
C 3.428212 0.668767 0.976066
C 3.278353 0.143947 -1.414419
C 4.045624 0.323113 -0.245134
C 0.028687 -3.416284 -0.533900
H -3.005881 -0.453165 1.751764
H -3.091529 1.011696 -2.159388
H -0.618946 0.155563 2.004647
H -0.414754 1.878601 0.379086
H -0.679583 1.680639 -2.039980
H -0.882655 -0.099109 -1.927475
H -2.135174 2.238910 1.785001
H -3.857956 1.821517 1.668831
H -3.951114 2.624716 -0.548372
H -2.237020 3.093832 -0.472757
H -4.730800 -1.302517 0.198241
H -4.769967 -0.685374 -1.476402
H -5.132705 0.421993 -0.109772
H 1.557447 1.109903 1.963669
H 1.293217 0.151128 -2.266252
H 4.022768 0.815104 1.882546
H 3.758872 -0.119784 -2.360968
H 0.625447 -3.506212 -1.452404
H -0.955903 -3.900207 -0.646881
H 0.554699 -3.857647 0.328773


