%chk=000281632.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281632

0 1
O 4.322030 0.127571 -0.014292
O 0.846991 2.141853 0.673207
O 2.843727 0.343834 -1.714972
O -1.127568 3.184360 0.324593
N -0.187427 -1.354419 0.552850
C -0.558454 -2.634463 1.266593
C -1.374498 -0.869968 -0.101558
C -2.054945 -2.908277 0.977209
C -2.489027 -1.723330 0.163262
C 1.049482 -1.447121 -0.273087
C -1.552472 0.320090 -0.815039
C -3.756480 -1.409903 -0.287858
C 2.143702 -0.617438 0.422792
C -2.857462 0.626037 -1.264933
C -0.450105 1.297357 -1.098257
C -3.933485 -0.218353 -1.016674
C 3.073298 -0.007815 -0.579065
C -0.357739 2.310333 0.012276
C 5.345081 0.760402 -0.828786
C 1.110500 3.023980 1.795894
H -0.386181 -2.451048 2.348080
H 0.078366 -3.486885 0.967026
H -2.205760 -3.854316 0.427617
H -2.636544 -2.990918 1.913248
H 0.876553 -1.052679 -1.305658
H 1.389434 -2.497264 -0.398457
H -4.603076 -2.061365 -0.086722
H 1.665199 0.221042 1.006651
H 2.687052 -1.211364 1.182965
H -3.020234 1.558673 -1.807467
H 0.532674 0.787586 -1.258796
H -0.634687 1.840950 -2.053949
H -4.925670 0.044689 -1.378267
H 6.258069 0.578974 -0.252646
H 5.383225 0.291850 -1.817850
H 5.119559 1.827577 -0.914955
H 0.586307 2.628586 2.671248
H 0.774147 4.042844 1.571907
H 2.197519 2.969239 1.907070


%chk=000281632-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000281632

0 1
O 4.308958 -0.098728 0.435932
O 0.502688 2.313770 0.519081
O 3.236023 0.442101 -1.559283
O -1.010601 3.607283 -0.685463
N -0.192488 -1.860226 -0.348909
C -0.359805 -3.052079 0.528068
C -1.338885 -1.033766 -0.255526
C -1.896352 -3.187449 0.688394
C -2.390306 -1.780099 0.376627
C 1.150012 -1.503010 -0.791233
C -1.592431 0.300280 -0.692977
C -3.665087 -1.244021 0.572524
C 1.974464 -0.670013 0.242546
C -2.906238 0.816807 -0.486904
C -0.587539 1.255632 -1.358352
C -3.931982 0.079634 0.132166
C 3.196262 -0.058564 -0.408756
C -0.415015 2.519451 -0.522176
C 5.544845 0.524418 -0.102565
C 0.687839 3.458738 1.444393
H 0.125013 -2.886582 1.516586
H 0.108031 -3.938026 0.061738
H -2.305287 -3.907571 -0.047411
H -2.182178 -3.538508 1.694483
H 1.110956 -0.954803 -1.747138
H 1.690960 -2.444691 -1.004583
H -4.447886 -1.841633 1.054299
H 1.351180 0.169346 0.608537
H 2.275319 -1.274701 1.113485
H -3.109174 1.842091 -0.821497
H 0.401617 0.809090 -1.518996
H -0.974204 1.578866 -2.340720
H -4.922268 0.524565 0.272486
H 6.287789 0.411356 0.699157
H 5.865758 0.004157 -1.020551
H 5.365545 1.587537 -0.334995
H -0.263405 3.692906 1.951066
H 1.031522 4.346838 0.888381
H 1.447450 3.120507 2.163289


