%chk=000261224.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261224

0 1
O -5.251987 -0.737386 -0.333093
O -4.810749 -0.798386 1.875816
N 3.051670 1.024288 -0.552815
N 1.878494 0.474636 -0.250763
N 0.848350 0.838788 -0.916362
C 4.270906 0.266417 -0.091376
C 4.179156 -0.040149 1.416231
C 4.471189 -1.027772 -0.906944
C 5.452441 -0.759083 1.879093
C 5.740211 -1.751369 -0.439009
C 5.695772 -2.039855 1.068298
C 3.243730 1.942427 -1.709657
C -0.432190 0.411355 -0.434959
C -0.747902 0.236567 0.927603
C -1.426083 0.248571 -1.424726
C -3.039344 -0.261452 0.311393
C -2.048622 -0.097901 1.294597
C -2.721816 -0.086079 -1.046978
C -4.404183 -0.617195 0.747020
C -6.647709 -1.089414 -0.033807
C -7.309507 -1.131837 -1.394359
H 5.140902 0.954741 -0.267858
H 3.290456 -0.668918 1.628006
H 4.028064 0.894135 1.988316
H 4.533569 -0.801436 -1.986534
H 3.591579 -1.691517 -0.785050
H 5.368229 -1.005441 2.954935
H 6.325113 -0.084068 1.790201
H 6.633935 -1.144408 -0.680218
H 5.855680 -2.698706 -0.999655
H 6.641091 -2.515785 1.389138
H 4.894940 -2.774259 1.283581
H 4.204370 2.469125 -1.621449
H 2.437646 2.701973 -1.724088
H 3.205063 1.409799 -2.674088
H 0.022198 0.363191 1.687208
H -1.170172 0.391529 -2.474401
H -2.309856 -0.236628 2.348146
H -3.503628 -0.215679 -1.801069
H -6.642594 -2.062185 0.487330
H -7.054466 -0.309542 0.632868
H -8.372557 -1.386164 -1.310418
H -7.231165 -0.163554 -1.907701
H -6.832727 -1.874677 -2.048503


%chk=000261224-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000261224

0 1
O -5.381332 -0.614059 -0.349078
O -4.624838 -1.629056 1.610361
N 3.069624 0.790358 -0.802069
N 1.875354 0.324280 -0.371839
N 0.857793 0.708425 -1.127450
C 4.279781 0.257320 -0.118772
C 4.059748 0.046613 1.396937
C 4.779004 -1.050568 -0.793285
C 5.366677 -0.445791 2.064442
C 6.077955 -1.556241 -0.120709
C 5.886385 -1.744639 1.402691
C 3.184231 1.586460 -2.039848
C -0.404305 0.251339 -0.641421
C -0.615668 -0.472542 0.571326
C -1.522813 0.570863 -1.461110
C -3.027987 -0.546665 0.113368
C -1.911943 -0.863479 0.936990
C -2.820020 0.176592 -1.091472
C -4.375204 -0.988895 0.554832
C -6.765897 -1.025256 0.022329
C -7.687433 -0.522273 -1.084761
H 5.061579 1.034852 -0.246020
H 3.256122 -0.696694 1.546544
H 3.714792 0.992079 1.855853
H 4.946146 -0.881275 -1.874948
H 3.980650 -1.813177 -0.698593
H 5.188903 -0.610802 3.144114
H 6.145338 0.341771 1.987019
H 6.893599 -0.824556 -0.299433
H 6.395416 -2.506430 -0.590894
H 6.839463 -2.056826 1.871040
H 5.157085 -2.561272 1.580758
H 4.241701 1.856906 -2.184980
H 2.563943 2.496264 -1.961015
H 2.811653 1.017566 -2.912312
H 0.242590 -0.712513 1.205199
H -1.341644 1.129843 -2.384885
H -2.093608 -1.418656 1.863632
H -3.679407 0.420012 -1.722020
H -6.788564 -2.125604 0.125123
H -7.008937 -0.587045 1.007596
H -8.732403 -0.803207 -0.858510
H -7.634247 0.576526 -1.172925
H -7.411782 -0.963852 -2.057905


