%chk=000240964.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240964

0 1
O -3.382370 -1.106642 -2.393003
O 1.974359 -0.552178 -3.623067
N -0.104068 -1.318196 -0.604658
C -0.886484 -2.570147 -0.327502
C -0.865742 -0.391783 -1.511385
C 1.228164 -1.661829 -1.213042
C -0.339046 -3.244264 0.942045
C -2.110843 0.129671 -0.840441
C 2.131464 -0.456487 -1.274765
C -1.151744 -4.496349 1.295783
C -2.057249 1.021472 0.281383
C 2.655877 0.168816 -0.095658
C -3.359847 -0.228182 -1.325256
C 2.506300 0.061405 -2.505780
C -3.267039 1.525460 0.836253
C 3.552141 1.266854 -0.223065
C -0.615971 -5.178093 2.552967
C -0.815278 1.431188 0.869964
C 2.306068 -0.274321 1.223086
C -4.580311 0.263887 -0.778848
C 3.396739 1.164857 -2.649994
C -4.524267 1.128589 0.284211
C 3.908753 1.749789 -1.520586
C -3.211552 2.428071 1.947195
C 4.088472 1.881069 0.954420
C -0.792043 2.294875 1.933839
C 2.832824 0.334125 2.332727
C -2.006591 2.805442 2.480758
C 3.741413 1.425519 2.199852
H -0.882060 -3.280468 -1.180940
H -1.951662 -2.291048 -0.162359
H -1.129224 -0.870094 -2.485247
H -0.200982 0.469217 -1.761302
H 1.130035 -2.112728 -2.230145
H 1.707208 -2.441583 -0.573896
H -0.366332 -2.520579 1.781427
H 0.727623 -3.508804 0.808819
H -1.136378 -5.209672 0.448729
H -2.215604 -4.224487 1.444145
H -1.203724 -6.068509 2.801795
H 0.425351 -5.495506 2.427832
H -0.651782 -4.508158 3.419889
H 0.114722 1.021311 0.463378
H 1.588499 -1.093338 1.323678
H -5.527278 -0.049670 -1.206927
H 3.654461 1.522834 -3.642241
H -5.439208 1.525287 0.724604
H 4.595070 2.593785 -1.595823
H -4.146599 2.805973 2.356866
H 4.776741 2.716762 0.837332
H 0.153580 2.601419 2.379316
H 2.563448 -0.002819 3.332889
H -1.954998 3.491367 3.323350
H 4.146044 1.884281 3.099517
H -4.302327 -1.276127 -2.704848
H 2.300543 -0.138465 -4.457468


%chk=000240964-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240964

0 1
O -3.375380 -1.100248 -2.472883
O 1.971600 -0.583172 -3.687778
N -0.081280 -1.300824 -0.539192
C -0.848342 -2.545197 -0.250490
C -0.848584 -0.357856 -1.420710
C 1.248048 -1.622822 -1.153358
C -0.342058 -3.310424 0.990714
C -2.145955 0.138499 -0.802690
C 2.179341 -0.427146 -1.288517
C -1.205784 -4.556457 1.294657
C -2.151653 1.029802 0.334247
C 2.762781 0.213166 -0.132507
C -3.381613 -0.219358 -1.366762
C 2.546559 0.043120 -2.560289
C -3.406206 1.540954 0.855495
C 3.708428 1.301516 -0.301035
C -0.718941 -5.333309 2.536962
C -0.935266 1.441590 0.977835
C 2.437312 -0.196652 1.206436
C -4.624657 0.274571 -0.855816
C 3.473731 1.119947 -2.735855
C -4.633040 1.140884 0.233962
C 4.044157 1.733914 -1.624592
C -3.397659 2.439483 1.972966
C 4.293533 1.919661 0.852634
C -0.957689 2.320937 2.062972
C 3.026715 0.422557 2.311572
C -2.196421 2.828807 2.568200
C 3.964920 1.489294 2.139260
H -0.856801 -3.230874 -1.137273
H -1.897943 -2.249990 -0.070413
H -1.070355 -0.825593 -2.404874
H -0.184581 0.505778 -1.613271
H 1.116776 -2.089612 -2.155646
H 1.732884 -2.373726 -0.502571
H -0.358243 -2.622090 1.858894
H 0.710319 -3.633257 0.854750
H -1.202939 -5.228746 0.412100
H -2.258942 -4.241905 1.443231
H -1.349809 -6.219714 2.734002
H 0.322513 -5.682438 2.403099
H -0.743830 -4.693002 3.438784
H 0.013499 1.030811 0.626755
H 1.688272 -0.980151 1.348520
H -5.567264 -0.031349 -1.329485
H 3.732071 1.454920 -3.749365
H -5.581858 1.525562 0.625704
H 4.757462 2.555947 -1.754077
H -4.354949 2.818109 2.352070
H 5.007273 2.739542 0.705887
H -0.015127 2.618671 2.536477
H 2.762616 0.094471 3.323327
H -2.197280 3.516987 3.420789
H 4.417520 1.965249 3.016063
H -4.298583 -1.263011 -2.787786
H 2.297999 -0.163026 -4.521327


