%chk=000281725.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281725

0 1
O 2.233211 0.646534 0.684159
O 1.089156 3.883377 0.020104
O 3.965000 -1.775576 -0.186888
O -4.959504 0.034250 -0.005923
N -2.904293 -0.330910 0.620249
N -4.205868 -0.259154 0.886192
C -0.198858 0.658164 0.503745
C -1.286028 1.154382 -0.479078
C 1.057816 1.565035 0.667163
C -2.267009 -0.035216 -0.709600
C -0.855675 0.366069 1.868700
C 0.427979 -0.577757 -0.096331
C -1.623637 -1.323658 -1.281434
C -1.982523 -0.671096 1.745330
C -0.197174 -1.542929 -0.871103
C 1.314313 2.560013 -0.490667
C -0.675974 1.692060 -1.740236
C 1.818056 -0.550075 0.099033
C 0.495212 2.334578 -1.732409
C 0.595842 -2.620492 -1.315366
C 2.608135 -1.616970 -0.341260
C 1.961579 -2.668115 -1.033526
C 4.659814 -0.676001 0.460124
H -1.866511 1.991043 -0.006646
H 1.131647 2.078437 1.646102
H -3.082793 0.292427 -1.410679
H -1.244245 1.305534 2.306874
H -0.094408 -0.014991 2.580413
H -1.663146 -1.271528 -2.392173
H -2.246553 -2.202717 -1.009975
H -1.553465 -1.682816 1.549760
H -2.557268 -0.736019 2.696994
H 2.411836 2.569475 -0.717989
H -1.247206 1.541191 -2.655977
H 0.931035 2.751702 -2.640754
H 0.144003 -3.420873 -1.898247
H 2.569990 -3.507648 -1.371471
H 0.138625 4.115713 -0.011638
H 4.261169 -0.518478 1.467938
H 4.563303 0.233396 -0.141522
H 5.692415 -1.040662 0.483812


%chk=000281725-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000281725

0 1
O 2.263706 0.717933 0.618068
O 0.966596 4.028301 -0.146171
O 4.047679 -1.670730 -0.315946
O -4.963054 -0.071536 0.103676
N -2.812678 -0.382500 0.718621
N -4.155443 -0.361979 1.065038
C -0.175302 0.707670 0.459125
C -1.333067 1.172553 -0.468995
C 1.059276 1.651906 0.554565
C -2.304093 -0.046179 -0.637342
C -0.755497 0.388853 1.871991
C 0.454282 -0.528577 -0.172368
C -1.653265 -1.285261 -1.323346
C -1.858618 -0.690435 1.800016
C -0.194705 -1.503992 -0.938880
C 1.248746 2.642106 -0.628930
C -0.800056 1.720731 -1.777684
C 1.843577 -0.500595 0.020135
C 0.399219 2.358603 -1.852922
C 0.611910 -2.568705 -1.424016
C 2.655084 -1.567908 -0.427777
C 1.995034 -2.607696 -1.142627
C 4.697830 -0.974436 0.812004
H -1.922300 1.963536 0.044064
H 1.100330 2.233549 1.489887
H -3.199518 0.255472 -1.213725
H -1.168473 1.320493 2.306902
H 0.052556 0.032367 2.537257
H -1.707411 -1.133878 -2.420522
H -2.276432 -2.174463 -1.108858
H -1.397643 -1.678584 1.611388
H -2.438318 -0.749783 2.736081
H 2.323270 2.661338 -0.874946
H -1.425053 1.612701 -2.674967
H 0.756491 2.767935 -2.805163
H 0.167102 -3.365296 -2.031456
H 2.617479 -3.431254 -1.506939
H 0.021451 4.244022 -0.356775
H 4.319396 -1.364205 1.776155
H 4.529810 0.114022 0.764384
H 5.768103 -1.206401 0.706795


