%chk=000253084.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000253084

0 1
O -3.833255 -0.444381 0.517656
O 4.034829 2.933677 -0.415275
O 1.944476 2.406169 -0.341092
O 7.030658 -2.432978 0.005178
O 7.513341 -0.332408 -0.193413
N 0.268402 -1.076461 -0.020066
N 1.183455 -0.047342 -0.147514
N 3.145555 2.108907 -0.335079
N 6.722450 -1.256458 -0.096711
C -2.878830 0.654966 0.717876
C -1.681242 0.519315 -0.229759
C -1.016747 -0.823441 -0.052941
C -1.947428 -1.953751 0.071953
C -3.672036 1.909223 0.446181
C -3.310747 -1.698779 0.336228
C -1.548872 -3.295939 -0.092121
C -4.262268 -2.733816 0.414023
C -3.329700 3.091430 1.119535
C -4.729599 1.903869 -0.472167
C -2.479197 -4.327086 -0.009660
C -3.833694 -4.043986 0.237914
C -4.042330 4.265376 0.863843
C -5.443057 3.080695 -0.718544
C 2.526699 -0.348883 -0.120608
C -5.098700 4.261574 -0.054251
C 3.498625 0.705121 -0.224094
C 2.998870 -1.700151 0.001096
C 4.876292 0.388292 -0.216083
C 5.291481 -0.929184 -0.103571
C 4.336815 -1.984940 0.008949
H -2.566377 0.574274 1.785692
H -0.994070 1.377926 -0.075229
H -2.021966 0.614194 -1.288794
H -0.497259 -3.519139 -0.290506
H -5.303908 -2.489273 0.613648
H -2.513081 3.101529 1.839601
H -4.999605 0.975799 -0.979516
H -2.160410 -5.359735 -0.138709
H -4.554160 -4.861972 0.295622
H -3.775335 5.185682 1.382312
H -6.268419 3.075309 -1.429457
H 0.872921 0.954226 -0.234131
H -5.653024 5.178760 -0.249274
H 2.256973 -2.502084 0.089675
H 5.618659 1.203760 -0.299711
H 4.704814 -3.016085 0.100694


%chk=000253084-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000253084

0 1
O -3.935036 -0.497894 0.201324
O 3.857974 2.999477 -0.816074
O 1.685906 2.325760 -0.673392
O 7.136642 -2.281602 0.075734
O 7.525793 -0.067762 -0.342156
N 0.245563 -1.215826 0.012542
N 1.120194 -0.161545 -0.196169
N 2.980918 2.074009 -0.642355
N 6.734492 -1.069988 -0.140905
C -2.998830 0.568133 0.656354
C -1.662595 0.455164 -0.115461
C -1.053658 -0.933262 0.044975
C -1.996091 -2.053690 0.186880
C -3.683881 1.904230 0.451316
C -3.401929 -1.795465 0.210913
C -1.564925 -3.412495 0.216728
C -4.338165 -2.853971 0.227887
C -3.533241 2.927272 1.418132
C -4.433715 2.160254 -0.723361
C -2.489883 -4.466928 0.250849
C -3.883372 -4.185066 0.246398
C -4.113207 4.198755 1.209909
C -5.022100 3.427441 -0.926319
C 2.479506 -0.378755 -0.184537
C -4.858754 4.451799 0.035989
C 3.417116 0.701488 -0.402367
C 3.015344 -1.688703 0.047326
C 4.810235 0.470373 -0.386988
C 5.281646 -0.826479 -0.157490
C 4.387905 -1.914559 0.060838
H -2.804241 0.395899 1.735839
H -0.996762 1.256050 0.256767
H -1.848856 0.663897 -1.188672
H -0.489101 -3.608136 0.192996
H -5.404253 -2.609312 0.240204
H -2.966385 2.731860 2.337245
H -4.577139 1.358898 -1.455873
H -2.140018 -5.503846 0.272377
H -4.609752 -5.004534 0.265780
H -3.989943 4.984943 1.962621
H -5.608703 3.616985 -1.832018
H 0.840445 0.824120 -0.386135
H -5.313356 5.435488 -0.125035
H 2.303377 -2.498799 0.212996
H 5.503286 1.299143 -0.552308
H 4.801549 -2.911019 0.236092


