%chk=000295539.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000295539

0 1
O -4.562571 -2.122480 -0.745300
O 4.558602 2.124950 0.735089
O -7.139963 -1.285846 0.123771
O 7.135536 1.287168 -0.134117
O -0.133815 -1.446341 -2.251731
O 0.129067 1.451313 2.240134
N -1.142384 0.543995 0.616435
N 1.137628 -0.539242 -0.627896
C -1.330666 -0.213446 -0.570574
C 1.325845 0.217687 0.559450
C -3.822141 0.078170 -0.652844
C 3.817090 -0.075318 0.642415
C -2.538314 -0.439045 -1.130799
C 2.533415 0.442473 1.120175
C -0.107986 -0.786395 -1.227994
C 0.103229 0.791061 1.216594
C -4.897116 -0.818219 -0.473606
C 4.892550 0.820554 0.463492
C -4.022973 1.450920 -0.412434
C 4.017266 -1.448155 0.401926
C -6.157059 -0.323232 -0.031341
C 6.152289 0.324929 0.021310
C -5.259767 1.921465 0.012871
C 5.253874 -1.919309 -0.023203
C -6.331589 1.038439 0.209994
C 6.326168 -1.036789 -0.220128
C -5.608604 -3.126291 -0.697535
C 5.605333 3.128092 0.688685
C -8.449981 -0.838463 0.550866
C 8.446601 0.838645 -0.556802
H -2.606495 -1.089195 -2.020394
H 2.601667 1.092310 2.009969
H -1.981283 0.892511 1.095263
H 1.976563 -0.887541 -1.106824
H -3.202100 2.147343 -0.585490
H 3.195963 -2.144139 0.574749
H -5.405404 2.985607 0.194982
H 5.399026 -2.983502 -0.205368
H -7.287275 1.429788 0.548043
H 7.281658 -1.428582 -0.558234
H -6.404280 -2.879138 -1.407015
H -5.998833 -3.209497 0.322776
H -5.061732 -4.028040 -0.997462
H 5.996324 3.211616 -0.331321
H 6.400401 2.880023 1.398525
H 5.058848 4.030002 0.988824
H -9.006126 -1.784301 0.582203
H -8.879570 -0.155244 -0.187332
H -8.392571 -0.385203 1.544724
H 9.003500 1.784074 -0.586918
H 8.391855 0.384930 -1.550607
H 8.873503 0.155488 0.183004


%chk=000295539-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000295539

0 1
O -4.856628 -2.364749 -0.329907
O 4.851237 2.366888 0.319256
O -7.410672 -1.311892 0.262482
O 7.406063 1.314640 -0.273157
O -0.330887 -2.147672 -1.676589
O 0.326627 2.149182 1.666960
N -1.061314 0.703282 0.503121
N 1.057049 -0.701835 -0.512661
C -1.366544 -0.385351 -0.345362
C 1.362289 0.386753 0.335895
C -3.916276 -0.153012 -0.333029
C 3.912191 0.154755 0.323904
C -2.641447 -0.790811 -0.671022
C 2.637161 0.792357 0.661565
C -0.209793 -1.156463 -0.894301
C 0.205532 1.157936 0.884720
C -5.075465 -0.985599 -0.221671
C 5.070994 0.987800 0.211922
C -4.073188 1.259031 -0.171312
C 4.069787 -1.257363 0.163431
C -6.345041 -0.410783 0.094297
C 6.340820 0.413298 -0.103771
C -5.331987 1.816928 0.106203
C 5.328821 -1.814901 -0.113706
C -6.468774 0.989059 0.251240
C 6.465179 -0.986608 -0.259593
C -5.764473 -3.178571 -1.168970
C 5.757995 3.182105 1.158160
C -8.709463 -0.760002 0.658274
C 8.704966 0.762795 -0.668649
H -2.687617 -1.733921 -1.224588
H 2.683149 1.735662 1.214812
H -1.840153 1.198324 0.949617
H 1.835866 -1.196754 -0.959315
H -3.225303 1.926442 -0.358362
H 3.222325 -1.925061 0.351332
H -5.439113 2.902053 0.203836
H 5.436467 -2.900060 -0.210386
H -7.437031 1.437751 0.490656
H 7.433611 -1.435033 -0.498806
H -5.852443 -2.739334 -2.180678
H -6.759773 -3.259926 -0.706098
H -5.273849 -4.161887 -1.228388
H 6.753481 3.263933 0.695812
H 5.845731 2.743742 2.170266
H 5.266520 4.165061 1.216532
H -9.370021 -1.633268 0.761863
H -9.111295 -0.077440 -0.115361
H -8.638607 -0.228079 1.626344
H 9.365259 1.636163 -0.773074
H 8.634148 0.230028 -1.636258
H 9.107092 0.081009 0.105516


