%chk=000270751.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270751

0 1
O 4.541171 0.113210 -2.222731
O -4.541242 0.118907 2.222684
O 7.407093 -2.645080 0.132789
O -7.407038 -2.645772 -0.125489
N 1.439252 2.015222 0.072079
N -1.439455 2.014972 -0.077165
N 3.664639 1.251358 0.517949
N -3.664816 1.249851 -0.521009
N 6.101225 -1.223608 1.386922
N -6.101228 -1.227587 -1.383400
N 4.554116 0.437198 2.462564
N -4.554270 0.430496 -2.463451
N 5.975992 -1.264799 -1.053051
N -5.975956 -1.262318 1.056671
C 0.692667 0.780345 -0.336750
C 0.690683 3.243603 -0.347683
C -0.692826 0.781222 0.334978
C -0.690928 3.244503 0.339293
C 2.837217 2.014886 -0.448757
C -2.837425 2.015985 0.443660
C 4.588948 0.252439 0.158329
C -4.589039 0.251811 -0.158737
C 5.129707 -0.225902 1.384859
C -5.129783 -0.229808 -1.383988
C 3.661110 1.319627 1.904337
C -3.661316 1.314457 -1.907573
C 4.973975 -0.241585 -1.140498
C -4.974009 -0.238807 1.141398
C 6.557914 -1.775033 0.150073
C -6.557836 -1.775795 -0.145092
C 6.666019 -1.714400 2.667493
C -6.666039 -1.721771 -2.662658
C 6.478768 -1.874776 -2.315368
C -6.478685 -1.868975 2.320606
H 1.268000 -0.108543 0.006734
H 0.579320 0.693454 -1.440635
H 0.560337 3.310487 -1.451207
H 1.259912 4.140691 -0.020602
H -1.268127 -0.108606 -0.006119
H -0.579476 0.697298 1.439092
H -0.560583 3.314359 1.442633
H -1.260186 4.140690 0.009802
H 3.235772 3.059189 -0.504109
H 2.963978 1.546982 -1.465914
H -3.236016 3.060418 0.496222
H -2.964180 1.550792 1.462062
H 3.023335 1.987535 2.474297
H -3.023605 1.980909 -2.479307
H 7.417213 -2.504397 2.475729
H 5.863460 -2.128470 3.304094
H 7.148863 -0.884658 3.214359
H -5.863475 -2.137445 -3.298206
H -7.148969 -0.893500 -3.211675
H -7.417165 -2.511321 -2.468795
H 5.971768 -1.415158 -3.184718
H 6.285061 -2.961522 -2.320777
H 7.567272 -1.717564 -2.410804
H -7.567280 -1.711993 2.415405
H -5.972049 -1.406691 3.188754
H -6.284484 -2.955612 2.329101


%chk=000270751-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000270751

0 1
O 4.690885 0.325934 -2.293786
O -4.689321 0.331349 2.293302
O 7.556912 -2.623926 0.014115
O -7.556163 -2.624702 -0.005643
N 1.434547 2.046412 0.085750
N -1.434954 2.046468 -0.091990
N 3.629018 1.133645 0.542741
N -3.629713 1.132728 -0.545863
N 6.095062 -1.320645 1.308160
N -6.095676 -1.323966 -1.303781
N 4.460316 0.159196 2.437906
N -4.462091 0.153625 -2.438152
N 6.122979 -1.142374 -1.102826
N -6.121856 -1.140137 1.106805
C 0.701404 0.816954 -0.313309
C 0.701564 3.270207 -0.320134
C -0.701983 0.817754 0.309705
C -0.701718 3.271035 0.311124
C 2.842856 2.044701 -0.328702
C -2.843149 2.045954 0.322922
C 4.613588 0.218698 0.129215
C -4.613755 0.218499 -0.129499
C 5.100141 -0.355557 1.315998
C -5.101002 -0.358656 -1.314590
C 3.578706 1.059650 1.925000
C -3.580349 1.055500 -1.927978
C 5.092706 -0.143129 -1.180565
C -5.091821 -0.140415 1.181468
C 6.647253 -1.749283 0.078249
C -6.646831 -1.749922 -0.072475
C 6.583153 -1.903716 2.573786
C -6.584566 -1.910090 -2.567693
C 6.719718 -1.617981 -2.372866
C -6.717481 -1.613030 2.378381
H 1.261463 -0.064608 0.045993
H 0.612130 0.743357 -1.423741
H 0.592973 3.340890 -1.429709
H 1.261116 4.157388 0.030935
H -1.262213 -0.064491 -0.047653
H -0.612685 0.746559 1.420291
H -0.593084 3.344187 1.420539
H -1.261122 4.157524 -0.041928
H 3.236940 3.073077 -0.227067
H 3.025257 1.702535 -1.370752
H -3.237148 3.074108 0.218757
H -3.025192 1.706480 1.365917
H 2.880708 1.651544 2.509365
H -2.882910 1.646184 -2.514234
H 7.356828 -2.643243 2.322057
H 5.751037 -2.387697 3.111602
H 7.004750 -1.112800 3.216231
H -5.752761 -2.395213 -3.104961
H -7.006739 -1.120749 -3.211696
H -7.357952 -2.649140 -2.313680
H 6.230366 -1.069307 -3.190510
H 6.558799 -2.702795 -2.482839
H 7.805453 -1.428943 -2.373270
H -7.803300 -1.424486 2.379101
H -6.227797 -1.062228 3.194394
H -6.555990 -2.697512 2.490782


