%chk=000215802.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215802

0 1
O 3.622593 3.971639 -0.675758
O 4.147602 -3.535999 0.645387
N -2.043975 1.210162 -0.236861
N -1.850710 -1.569789 0.311960
C -0.858713 0.617251 -0.103772
C -0.758639 -0.823478 0.160008
C -3.192685 0.436867 -0.098119
C -3.091214 -0.956417 0.193466
C 0.340620 1.472019 -0.221549
C 0.547316 -1.508281 0.254374
C -4.477860 1.041912 -0.235468
C -5.612906 0.276390 -0.080873
C -4.285395 -1.729810 0.351205
C -5.506794 -1.123662 0.216227
C 0.469412 2.349632 -1.318177
C 1.331243 1.444416 0.770671
C 0.823560 -2.340199 1.359046
C 1.497078 -1.365444 -0.767254
C -6.975128 0.872831 -0.215652
C 1.585325 3.166781 -1.437549
C 2.458522 2.263917 0.675040
C 2.042214 -2.998253 1.456191
C 2.726969 -2.024144 -0.693752
C 2.574285 3.114709 -0.431856
C 2.986759 -2.831913 0.420753
C 4.689158 4.035264 0.301960
C 5.184411 -3.474918 -0.363832
H -4.523179 2.108289 -0.459115
H -4.187063 -2.793680 0.574908
H -6.424610 -1.699632 0.332708
H -0.319937 2.387357 -2.072469
H 1.225227 0.776060 1.627695
H 0.068099 -2.469608 2.137200
H 1.278122 -0.732510 -1.629510
H 1.708994 3.848099 -2.276195
H 3.216275 2.231140 1.450054
H 2.279732 -3.641805 2.300104
H 3.451699 -1.903591 -1.491306
H -7.555995 0.755124 0.710961
H -6.948677 1.947398 -0.442578
H -7.545199 0.388529 -1.022034
H 5.188686 3.065894 0.383169
H 4.301294 4.377866 1.265652
H 5.355523 4.786180 -0.142638
H 5.957855 -4.121865 0.070670
H 5.547115 -2.449269 -0.474588
H 4.818392 -3.883958 -1.310002


%chk=000215802-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000215802

0 1
O 3.472111 4.435889 -0.597235
O 4.046418 -4.031478 0.510482
N -1.982027 1.147256 -0.440623
N -1.786640 -1.467646 0.667711
C -0.772982 0.611554 -0.139642
C -0.671147 -0.780915 0.315760
C -3.121806 0.404778 -0.190909
C -3.021051 -0.880978 0.462523
C 0.382463 1.545597 -0.243398
C 0.598545 -1.558025 0.356669
C -4.407246 0.934688 -0.519243
C -5.575400 0.240119 -0.179908
C -4.218434 -1.571729 0.825734
C -5.460749 -1.020285 0.509030
C 0.360292 2.573702 -1.229271
C 1.472261 1.512379 0.664434
C 0.769071 -2.572554 1.341683
C 1.616082 -1.394557 -0.618229
C -6.950507 0.787305 -0.513727
C 1.400176 3.509784 -1.326849
C 2.518310 2.456210 0.589571
C 1.923746 -3.368855 1.372742
C 2.776075 -2.197117 -0.609916
C 2.487409 3.454737 -0.416609
C 2.935554 -3.184264 0.395140
C 4.607317 4.437960 0.329118
C 5.110813 -3.894831 -0.487248
H -4.447235 1.906543 -1.022512
H -4.125497 -2.539919 1.327760
H -6.378488 -1.556652 0.780064
H -0.496485 2.625628 -1.907655
H 1.503471 0.750869 1.449457
H -0.029651 -2.728547 2.073078
H 1.501061 -0.643338 -1.405631
H 1.393436 4.294424 -2.089373
H 3.335823 2.407128 1.314832
H 2.064077 -4.142146 2.134036
H 3.533305 -2.049393 -1.385486
H -7.557116 0.929817 0.400745
H -6.887032 1.758277 -1.032786
H -7.509421 0.089689 -1.166175
H 5.178520 3.491221 0.267877
H 4.274746 4.603957 1.372157
H 5.241483 5.275713 0.004238
H 5.864043 -4.645908 -0.207780
H 5.562584 -2.884151 -0.458599
H 4.735119 -4.104435 -1.507536


