%chk=000298598.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298598

0 1
O 1.298180 -3.385278 -0.059023
N -0.394911 -2.015154 -0.800972
C 0.609952 0.136362 -0.458154
C 1.703566 -0.968851 -0.452887
C -0.666149 -0.567730 -1.027872
C 2.736480 -0.816157 0.666080
C 0.913605 -2.278846 -0.372817
C 3.807342 0.229903 0.317839
C 1.062058 1.335775 -1.232768
C -1.929631 -0.104440 -0.336456
C 3.626860 1.601519 0.982829
C 2.265857 2.277352 0.751486
C 1.834532 2.283029 -0.686195
C -2.229528 -0.506438 0.973305
C -2.805545 0.754720 -1.015827
C -3.398353 -0.057603 1.593738
C -3.971497 1.204798 -0.389887
C -4.270926 0.798479 0.914165
H 0.400519 0.443378 0.601653
H 2.236088 -0.973766 -1.439224
H -0.748061 -0.397960 -2.133943
H 3.221592 -1.803041 0.834049
H 2.244251 -0.568728 1.624754
H -1.146666 -2.688424 -0.785841
H 3.855345 0.366750 -0.781745
H 4.801908 -0.167108 0.606478
H 0.754100 1.381658 -2.275042
H 3.787936 1.505233 2.075341
H 4.430470 2.272850 0.617302
H 2.310967 3.318760 1.131417
H 1.496524 1.769496 1.375921
H 2.191773 3.129005 -1.273009
H -1.552119 -1.170839 1.509651
H -2.580620 1.077114 -2.031202
H -3.628994 -0.375520 2.609581
H -4.648097 1.872889 -0.920669
H -5.180605 1.147614 1.399244


%chk=000298598-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298598

0 1
O 1.422939 -3.451436 -0.007529
N -0.392157 -2.039436 -0.541850
C 0.593525 0.093261 -0.328390
C 1.716793 -0.988090 -0.441950
C -0.676946 -0.632833 -0.896803
C 2.919176 -0.859324 0.519039
C 0.944186 -2.318106 -0.286793
C 3.927551 0.264788 0.139101
C 0.924355 1.408254 -0.999556
C -1.997670 -0.126183 -0.331954
C 3.788562 1.612642 0.897151
C 2.362055 2.245807 0.923035
C 1.714538 2.366021 -0.442355
C -2.384221 -0.431092 0.998595
C -2.846311 0.685150 -1.123229
C -3.594254 0.069449 1.525633
C -4.054581 1.194347 -0.595821
C -4.432792 0.886848 0.730919
H 0.411230 0.258447 0.752824
H 2.110031 -0.981964 -1.482446
H -0.695952 -0.511655 -2.002970
H 3.431625 -1.840309 0.507501
H 2.554329 -0.720139 1.557319
H -1.096597 -2.776717 -0.594766
H 3.855721 0.453903 -0.950154
H 4.958580 -0.099292 0.317930
H 0.525910 1.563289 -2.013491
H 4.110254 1.475431 1.949789
H 4.498505 2.335046 0.445363
H 2.438875 3.246298 1.391108
H 1.721328 1.636541 1.589434
H 1.937328 3.271281 -1.025072
H -1.739102 -1.070493 1.613236
H -2.560424 0.919417 -2.156512
H -3.885358 -0.176525 2.553137
H -4.700861 1.822939 -1.218567
H -5.371967 1.275234 1.140396


