%chk=000273301.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273301

0 1
O 1.727633 0.171295 0.298740
O -2.877063 1.296323 -0.957286
O 0.117474 -4.726940 -0.536681
O 1.788059 -0.552341 -1.875542
O 1.227050 -3.269648 0.800414
O -2.099661 0.487627 1.056749
O 6.783361 3.349885 2.113776
O 7.384121 2.929986 0.078956
N -1.163951 -0.150115 -0.985116
N 6.596603 2.863616 1.009647
C -0.151173 -1.039928 -0.402551
C -0.301706 -2.470480 -0.939776
C 1.228314 -0.482369 -0.818510
C 0.452725 -3.467572 -0.103025
C -2.057732 0.533954 -0.153470
C -3.956772 2.025818 -0.276917
C 2.963045 0.808475 0.358280
C -5.131758 1.114692 -0.077026
C 3.201638 1.374204 1.626905
C 3.878191 0.896481 -0.696018
C -6.179112 1.097705 -1.008926
C -5.182754 0.278493 1.048618
C 5.330161 2.146581 0.783327
C 4.397139 2.047102 1.835594
C 5.075516 1.574651 -0.474494
C -7.277135 0.256101 -0.807977
C -6.281245 -0.561682 1.243854
C -7.330032 -0.571975 0.317815
C 0.764548 -5.842169 0.138659
H -0.231120 -1.029885 0.732363
H -1.381372 -2.757051 -0.972693
H 0.035607 -2.548398 -2.001541
H -1.238238 -0.078497 -1.999362
H -3.566961 2.443105 0.671391
H -4.137600 2.837538 -1.007870
H 2.453903 1.272087 2.415294
H 3.667042 0.444658 -1.670692
H -6.139700 1.735715 -1.890541
H -4.355205 0.280630 1.764774
H 4.626216 2.502159 2.807106
H 5.821298 1.666099 -1.274028
H -8.091759 0.245463 -1.530427
H -6.320240 -1.208801 2.119100
H -8.187223 -1.225438 0.473308
H 0.595476 -5.773792 1.218362
H 0.260085 -6.708685 -0.303020
H 1.834807 -5.829376 -0.090142


%chk=000273301-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000273301

0 1
O 1.725419 0.128205 0.400814
O -2.893978 1.281439 -0.765952
O 0.290523 -4.858162 -0.491127
O 1.725384 -0.781704 -1.775681
O 1.619311 -3.205284 0.473334
O -2.172984 0.317647 1.269427
O 6.860837 3.549944 1.929592
O 7.529020 2.809583 -0.122653
N -1.207282 -0.230025 -0.803653
N 6.670492 2.881550 0.840151
C -0.197401 -1.149032 -0.266302
C -0.398874 -2.583146 -0.801674
C 1.195317 -0.623755 -0.657590
C 0.613642 -3.540687 -0.196984
C -2.094847 0.440003 0.020077
C -3.996643 1.997956 -0.030345
C 2.985161 0.783040 0.394785
C -5.268032 1.178842 -0.001242
C 3.225101 1.525809 1.576044
C 3.942329 0.717799 -0.648940
C -6.229055 1.307855 -1.036169
C -5.513581 0.271492 1.062203
C 5.389945 2.153848 0.687058
C 4.435792 2.219424 1.728410
C 5.156753 1.414102 -0.491661
C -7.414719 0.540430 -1.014372
C -6.698829 -0.496345 1.084852
C -7.651672 -0.363774 0.047366
C 1.235310 -5.886224 0.019900
H -0.290695 -1.122466 0.830991
H -1.422192 -2.928405 -0.576647
H -0.278502 -2.604606 -1.901872
H -1.259252 -0.057885 -1.809633
H -3.629609 2.223176 0.985438
H -4.113505 2.924026 -0.614320
H 2.456741 1.541312 2.353476
H 3.742968 0.142296 -1.552637
H -6.046659 2.009175 -1.859798
H -4.766961 0.166728 1.857570
H 4.655222 2.802017 2.626247
H 5.923912 1.390755 -1.269842
H -8.152415 0.649007 -1.817198
H -6.881491 -1.193104 1.910474
H -8.572727 -0.957233 0.067527
H 1.286532 -5.840292 1.120252
H 0.815928 -6.842567 -0.320454
H 2.240772 -5.717466 -0.399840


