%chk=000268521.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268521

0 1
O -0.562124 -0.002411 -2.006353
O 2.066128 -1.222548 -0.459963
N -1.055699 -1.534513 -0.385955
N 1.375832 0.849660 0.275448
C -1.461725 -2.545288 -1.404848
C -1.058554 -1.967425 1.033529
C -2.944877 -2.932056 -1.291592
C 0.135991 -2.878805 1.360794
C -0.547546 -0.324279 -0.823829
C -0.036994 0.671067 0.208245
C -3.877039 -1.808400 -1.729705
C 0.191725 -3.197228 2.850397
C -0.851567 1.450132 0.946336
C -2.319274 1.430782 0.883399
C 2.348797 -0.085249 -0.149813
C 3.738285 0.475387 -0.123984
C -3.059276 1.336108 2.075119
C -2.989742 1.550322 -0.344959
C -4.454867 1.357033 2.032776
C -4.386209 1.579709 -0.376920
C 4.678194 -0.068269 0.760702
C 4.099550 1.498330 -1.010127
C -5.121005 1.481901 0.808774
C 5.984783 0.428255 0.767248
C 5.409329 1.985915 -1.001089
C 6.349359 1.453983 -0.111620
H -1.251431 -2.128350 -2.422120
H -0.819237 -3.446477 -1.289534
H -1.060855 -1.076446 1.699652
H -2.017445 -2.501184 1.232320
H -3.120342 -3.831366 -1.915776
H -3.183833 -3.233908 -0.251925
H 0.075207 -3.814413 0.771890
H 1.081482 -2.394211 1.030135
H -4.926710 -2.113021 -1.675636
H -3.671667 -1.490503 -2.759078
H -3.752978 -0.920990 -1.093051
H 1.036599 -3.858883 3.076819
H -0.717982 -3.702660 3.194120
H 0.316482 -2.292239 3.455770
H -0.447562 2.179850 1.653434
H 1.690192 1.759656 0.622785
H -2.545102 1.244411 3.029080
H -2.417488 1.618128 -1.274025
H -5.026167 1.278890 2.956121
H -4.902075 1.679234 -1.331210
H 4.393009 -0.878984 1.432195
H 3.367455 1.902017 -1.711627
H -6.208167 1.503992 0.779957
H 6.720599 0.010642 1.453390
H 5.698218 2.777909 -1.691202
H 7.369925 1.836588 -0.106796


%chk=000268521-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000268521

0 1
O -0.263865 0.011688 -2.072605
O 2.167015 -1.218329 -0.084575
N -0.991325 -1.536053 -0.470875
N 1.371132 0.943458 0.293197
C -1.292218 -2.523782 -1.540917
C -1.057063 -1.996567 0.934926
C -2.643503 -3.253751 -1.379712
C -0.140293 -3.205322 1.243715
C -0.430166 -0.333721 -0.854234
C -0.024247 0.680982 0.213615
C -3.868731 -2.317318 -1.420707
C -0.179037 -3.554535 2.746893
C -0.879965 1.500224 0.911920
C -2.346392 1.596276 0.852553
C 2.394598 0.023624 0.046601
C 3.780331 0.602291 -0.019892
C -3.027927 2.174867 1.965003
C -3.123353 1.197853 -0.275296
C -4.429717 2.318644 1.970578
C -4.526082 1.345606 -0.267994
C 4.868874 -0.257895 0.276645
C 4.038205 1.947203 -0.397510
C -5.189234 1.899307 0.852584
C 6.192394 0.224351 0.225172
C 5.365185 2.427134 -0.453367
C 6.444063 1.570204 -0.134589
H -1.266627 -1.967141 -2.493108
H -0.468026 -3.264257 -1.576273
H -0.770179 -1.151805 1.582284
H -2.107818 -2.249910 1.182422
H -2.707608 -3.989145 -2.206285
H -2.653919 -3.846610 -0.443497
H -0.461807 -4.087003 0.655757
H 0.887206 -2.953096 0.927902
H -4.810298 -2.891834 -1.346594
H -3.892729 -1.743077 -2.366132
H -3.845722 -1.590993 -0.589298
H 0.451827 -4.435012 2.965001
H -1.208052 -3.786044 3.083843
H 0.194776 -2.713529 3.361036
H -0.406947 2.199541 1.620341
H 1.645474 1.889551 0.566845
H -2.445024 2.505328 2.834291
H -2.627442 0.811917 -1.170320
H -4.929379 2.760553 2.840006
H -5.103522 1.040315 -1.148193
H 4.651789 -1.299509 0.535156
H 3.217961 2.609379 -0.700923
H -6.278704 2.015059 0.849047
H 7.026875 -0.444972 0.460766
H 5.557954 3.461264 -0.758862
H 7.472865 1.944384 -0.178642


