%chk=000281047.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281047

0 1
O 0.794685 4.333668 -1.408392
O 6.084933 -1.694364 -0.855947
O 6.521795 -1.368245 1.236705
N -0.398357 1.920375 -0.466086
N 0.369069 0.168093 1.169015
N -1.309593 0.563620 2.539604
N -0.118024 0.228749 2.470255
N 5.762342 -1.379053 0.280152
C -0.726912 0.625016 0.165988
C -1.933043 0.832537 1.194955
C -1.071049 -0.447340 -0.853761
C 0.661408 1.898126 -1.526929
C -0.100485 3.047617 0.481293
C -3.140734 -0.036334 0.955299
C 0.567927 3.224618 -2.300825
C -0.146472 4.361880 -0.318599
C 1.709243 -0.226661 0.937286
C -1.764925 -0.085053 -2.021382
C -0.795635 -1.801820 -0.613557
C -4.174512 0.469877 0.149636
C -3.260526 -1.313160 1.520775
C 2.135622 -0.618931 -0.352181
C 2.632027 -0.234875 2.015061
C -2.134630 -1.057836 -2.952552
C -1.167822 -2.772390 -1.548419
C -1.832070 -2.403469 -2.721311
C -5.314865 -0.300091 -0.088314
C -4.407462 -2.076776 1.281487
C 3.456615 -0.993905 -0.562091
C 3.948198 -0.611024 1.800078
C -5.434160 -1.574143 0.477555
C 4.366886 -0.986435 0.508400
H -2.258016 1.911907 1.196987
H 1.684498 1.797563 -1.097116
H 0.505241 1.043466 -2.217069
H -0.862148 3.082779 1.290479
H 0.892232 2.933364 0.971252
H -0.410998 3.349520 -2.795145
H 1.387232 3.336693 -3.033509
H 0.208328 5.220984 0.279404
H -1.155531 4.562555 -0.719811
H -2.027185 0.960393 -2.198618
H -0.296797 -2.115593 0.304571
H -4.088641 1.459720 -0.295567
H -2.469842 -1.714828 2.154183
H 1.435292 -0.657888 -1.186965
H 2.307561 0.051154 3.019227
H -2.668109 -0.767270 -3.856687
H -0.943686 -3.821172 -1.355454
H -2.121030 -3.161679 -3.448003
H -6.113945 0.093769 -0.714548
H -4.498703 -3.067028 1.726124
H 3.798256 -1.302276 -1.557827
H 4.672453 -0.618019 2.624124
H -6.325338 -2.171386 0.292971


%chk=000281047-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000281047

0 1
O 0.936893 4.514587 -1.416114
O 6.050510 -2.063478 -0.582997
O 6.346932 -1.748454 1.660142
N -0.335366 2.028493 -0.565558
N 0.262867 0.199944 1.050170
N -1.367871 1.040735 2.367056
N -0.154177 0.594349 2.356721
N 5.626192 -1.699170 0.585516
C -0.743980 0.725798 -0.004349
C -1.980829 0.950987 0.985291
C -1.089103 -0.295950 -1.091470
C 0.729500 2.052788 -1.615745
C -0.076232 3.135787 0.401733
C -3.091721 -0.094282 0.993168
C 0.690749 3.403860 -2.347547
C -0.066563 4.483702 -0.343502
C 1.597183 -0.248908 0.911958
C -1.714169 0.141119 -2.287015
C -0.921888 -1.685416 -0.877234
C -4.248272 0.121913 0.204412
C -3.007190 -1.264435 1.787109
C 2.117649 -0.665780 -0.348565
C 2.436594 -0.325517 2.067373
C -2.127748 -0.789517 -3.263722
C -1.337986 -2.616823 -1.851863
C -1.937353 -2.174504 -3.052900
C -5.295818 -0.823712 0.190943
C -4.057031 -2.208414 1.779281
C 3.434037 -1.138191 -0.454561
C 3.751408 -0.796558 1.960219
C -5.202856 -1.993924 0.979124
C 4.246585 -1.201636 0.698425
H -2.432310 1.927439 0.740120
H 1.738121 1.923428 -1.166852
H 0.562852 1.240441 -2.341025
H -0.857644 3.175625 1.178130
H 0.899682 2.989556 0.918969
H -0.296317 3.536780 -2.842514
H 1.494057 3.465546 -3.099917
H 0.207599 5.302704 0.341408
H -1.075964 4.675483 -0.769132
H -1.878457 1.213259 -2.439479
H -0.469733 -2.042999 0.053496
H -4.327441 1.031411 -0.403937
H -2.135441 -1.428302 2.429954
H 1.491352 -0.641660 -1.240673
H 2.038879 -0.010492 3.033184
H -2.604418 -0.433799 -4.183860
H -1.197384 -3.687684 -1.669717
H -2.258378 -2.898569 -3.809594
H -6.183498 -0.646307 -0.426118
H -3.984518 -3.106633 2.402502
H 3.841504 -1.463430 -1.415242
H 4.404966 -0.856024 2.834529
H -6.017856 -2.726166 0.976468


