%chk=000292672.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292672

0 1
O 2.151215 -2.279588 1.775576
N 3.037499 0.727123 -0.463379
N -0.101720 -2.001396 0.193679
N 1.166696 -1.774698 -0.273260
C -0.749293 6.175489 -1.044058
C -7.260153 -2.192684 -0.260650
C 0.364449 5.257718 -1.610827
C -1.109002 5.649051 0.369002
C -6.149695 -1.735734 -1.241476
C -6.561397 -2.700545 1.026763
C 0.623344 4.241356 -0.535040
C -0.212856 4.464206 0.588123
C -4.856534 -1.983203 -0.516544
C -5.091081 -2.530585 0.771142
C 1.530053 3.193648 -0.547148
C -3.568124 -1.742760 -0.962503
C -0.139450 3.636728 1.700818
C -4.030378 -2.835394 1.610463
C 1.609244 2.354649 0.585781
C -2.483880 -2.053741 -0.107043
C 0.781440 2.577952 1.695778
C -2.720554 -2.593535 1.163918
C 2.563051 1.224966 0.635529
C -1.117156 -1.792969 -0.601525
C 3.942047 -0.375358 -0.485665
C 3.571975 -1.665083 -0.054497
C 2.262798 -1.940806 0.621799
C 5.207099 -0.170128 -1.074984
C 4.466248 -2.734641 -0.213181
C 6.081104 -1.243358 -1.226644
C 5.714311 -2.527071 -0.797973
H -1.634291 6.165489 -1.700538
H -0.405051 7.221106 -0.994410
H -7.873694 -2.989469 -0.710840
H -7.943362 -1.359637 -0.030221
H 0.047053 4.772892 -2.551504
H 1.277946 5.831974 -1.847988
H -2.174352 5.362362 0.433428
H -0.947503 6.422774 1.141058
H -6.192114 -2.301972 -2.188822
H -6.261768 -0.669698 -1.507520
H -6.882674 -2.125298 1.913395
H -6.812378 -3.756724 1.231469
H 2.171905 3.006722 -1.408474
H -3.390800 -1.322521 -1.948339
H -0.781684 3.797695 2.563320
H -4.198354 -3.255021 2.599211
H 0.838841 1.920812 2.564185
H -1.876530 -2.829213 1.817903
H 2.809901 0.869039 1.654174
H -1.056785 -1.428356 -1.638104
H 1.338459 -1.414469 -1.223066
H 5.486097 0.827912 -1.412378
H 4.178948 -3.730260 0.133134
H 7.059580 -1.084486 -1.681915
H 6.405611 -3.359162 -0.918533


%chk=000292672-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000292672

0 1
O 2.277021 -3.927765 -0.012852
N 2.961985 0.322811 -0.099927
N 0.032233 -2.222597 -0.062092
N 1.335680 -1.769628 -0.092224
C -2.351623 4.297137 -0.704959
C -7.069834 -1.024861 -0.418447
C -1.436250 3.266607 -1.437957
C -1.365620 5.266160 0.021100
C -5.907943 -0.074223 0.012202
C -6.606979 -2.451678 0.016205
C -0.181558 3.243117 -0.574188
C -0.138987 4.397798 0.260457
C -4.685965 -0.985321 -0.022098
C -5.087923 -2.347248 -0.017715
C 0.853639 2.298712 -0.537438
C -3.321688 -0.645953 -0.033322
C 0.952342 4.612733 1.127126
C -4.118101 -3.375089 -0.022922
C 1.951547 2.492996 0.354901
C -2.335331 -1.675431 -0.046008
C 1.993733 3.659742 1.170872
C -2.748883 -3.040392 -0.039894
C 3.035845 1.511228 0.458314
C -0.916101 -1.304852 -0.069311
C 4.045798 -0.602750 -0.091548
C 3.775154 -2.014038 -0.096106
C 2.402216 -2.670008 -0.059988
C 5.395861 -0.151810 -0.153320
C 4.870550 -2.912660 -0.118664
C 6.465218 -1.066661 -0.185013
C 6.202693 -2.457150 -0.159508
H -2.966277 3.770629 0.048985
H -3.037279 4.822295 -1.391419
H -7.175136 -0.996339 -1.519055
H -8.041193 -0.738408 0.020938
H -1.908632 2.273867 -1.549309
H -1.187505 3.619483 -2.459311
H -1.784564 5.690535 0.951005
H -1.102547 6.122344 -0.633743
H -5.813428 0.808252 -0.646696
H -6.074453 0.305304 1.041434
H -6.952803 -2.680132 1.045615
H -7.003161 -3.247827 -0.639804
H 0.853454 1.421726 -1.194336
H -3.005915 0.406646 -0.031812
H 0.992534 5.501704 1.766434
H -4.423216 -4.428142 -0.020898
H 2.841591 3.805456 1.851892
H -1.974140 -3.813666 -0.053236
H 3.913291 1.810154 1.065752
H -0.688041 -0.219323 -0.087491
H 1.610735 -0.748991 -0.164604
H 5.598675 0.923057 -0.219782
H 4.629691 -3.980897 -0.106100
H 7.495568 -0.698695 -0.243327
H 7.028325 -3.175858 -0.186213


