%chk=000270297.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270297

0 1
O 0.971426 3.282561 2.542780
O -0.951860 2.689647 3.512263
N 0.945101 0.793372 1.362675
N -3.920120 0.254238 -0.472498
N -6.234603 -0.584501 -0.607949
N -4.690501 -0.802684 -2.434194
C 1.181910 -0.091250 0.161142
C -0.278306 1.658941 1.337917
C 2.654466 -0.548428 0.179320
C 0.414412 -1.412554 0.300083
C 0.836067 0.706238 -1.103267
C -1.583422 0.848991 1.370845
C -2.805628 1.739131 1.117908
C 3.288556 -0.921380 -1.016763
C 0.033249 -1.889759 1.563179
C 1.774572 1.603258 -1.638948
C 3.351508 -0.680300 1.389415
C 0.177135 -2.208544 -0.832083
C -0.440837 0.637895 -1.679842
C -0.192581 2.536946 2.589590
C -4.067457 0.900082 0.844013
C 4.609907 -1.373892 -1.005704
C -0.611425 -3.123596 1.686245
C 1.457468 2.378764 -2.756895
C 4.675406 -1.130049 1.397175
C -0.465777 -3.442388 -0.705297
C -0.758759 1.416652 -2.795830
C 5.310625 -1.472080 0.200572
C -0.867047 -3.901192 0.553097
C 0.191659 2.282870 -3.343272
C -4.909974 -0.321530 -1.092938
H -0.292126 2.354009 0.447953
H 1.767449 1.414902 1.477603
H -1.551653 0.053445 0.589971
H -1.682002 0.313523 2.335364
H -2.984985 2.393635 1.994989
H -2.620336 2.408259 0.253007
H 2.750869 -0.866593 -1.963823
H 0.242752 -1.294457 2.455111
H 2.761584 1.701391 -1.184861
H 2.861552 -0.451643 2.337928
H 0.501350 -1.872419 -1.816527
H -1.215809 -0.002217 -1.238001
H -4.190614 0.127775 1.638863
H -4.960901 1.561323 0.896784
H 5.092888 -1.655178 -1.939882
H -0.910454 -3.480569 2.670125
H 2.197849 3.062675 -3.168349
H 5.208456 -1.220651 2.342211
H -0.647559 -4.050339 -1.589068
H -1.756836 1.354829 -3.227975
H 6.340916 -1.821160 0.207681
H -1.369091 -4.860953 0.650699
H -0.054567 2.885979 -4.214776
H 1.088755 3.867948 3.334932
H -6.946056 -0.722815 -1.318062
H -6.564509 0.057094 0.103422
H -4.969327 -1.771821 -2.566737
H -3.722162 -0.685730 -2.736523


%chk=000270297-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270297

0 1
O 1.275739 3.109218 2.598365
O -0.948965 3.218099 3.231097
N 0.871562 0.776759 1.332146
N -3.750862 0.040598 -0.330555
N -6.026899 -0.801692 -0.359685
N -4.401132 -1.639501 -1.840400
C 1.113658 -0.057327 0.095556
C -0.286547 1.716686 1.356756
C 2.588182 -0.561956 0.173186
C 0.277865 -1.373806 0.120333
C 0.854701 0.812245 -1.167063
C -1.666916 1.032495 1.476857
C -2.837487 1.912160 0.987625
C 3.274648 -0.978048 -0.996944
C -0.123170 -1.934572 1.356338
C 1.852848 1.709561 -1.633864
C 3.236096 -0.723738 1.424698
C 0.040345 -2.112557 -1.066424
C -0.434287 0.881732 -1.760797
C -0.075997 2.723477 2.488086
C -4.088116 1.054881 0.693181
C 4.578146 -1.511723 -0.922778
C -0.770485 -3.187304 1.407536
C 1.592023 2.608521 -2.689981
C 4.544427 -1.253174 1.500453
C -0.609027 -3.365802 -1.019854
C -0.697908 1.782591 -2.817702
C 5.225031 -1.647904 0.327534
C -1.020829 -3.910235 0.218428
C 0.314348 2.643549 -3.296889
C -4.692537 -0.747328 -0.793247
H -0.310505 2.343619 0.428114
H 1.729432 1.302486 1.555061
H -1.667353 0.123306 0.856248
H -1.833669 0.714428 2.523850
H -3.077953 2.695352 1.730027
H -2.547228 2.418169 0.044834
H 2.789825 -0.881502 -1.974122
H 0.076820 -1.365030 2.269934
H 2.845095 1.703987 -1.168919
H 2.707173 -0.455540 2.344634
H 0.366694 -1.712235 -2.032510
H -1.256021 0.257847 -1.388600
H -4.418793 0.573153 1.645013
H -4.917835 1.723951 0.362049
H 5.088024 -1.823160 -1.841668
H -1.077428 -3.600502 2.375415
H 2.383989 3.282566 -3.036369
H 5.025891 -1.365453 2.478762
H -0.777764 -3.924035 -1.948699
H -1.703375 1.815430 -3.252596
H 6.237928 -2.061927 0.385741
H -1.519122 -4.885891 0.256876
H 0.110046 3.339188 -4.118809
H 1.364619 3.786028 3.322275
H -6.751630 -1.190181 -0.958473
H -6.313694 -0.229311 0.428737
H -4.867501 -2.546656 -1.851035
H -3.423515 -1.628289 -2.132966


