%chk=000189064.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189064

0 1
P 5.370870 -1.596383 -0.456920
P 0.751715 2.432273 -0.658272
P -2.240049 2.793561 -1.215128
P -3.065028 1.351596 1.388371
O 1.140470 -0.725064 1.200765
O 4.315633 -0.787362 0.521929
O 3.137662 -2.191294 -1.164235
O 0.671032 1.988974 0.941025
O 5.038751 -3.178218 -0.247137
O 4.983177 -1.214684 -2.037311
O 6.765301 -1.250030 -0.184360
O -0.721807 1.952866 -1.118321
O 0.748717 4.036787 -0.635237
O 1.804951 1.702726 -1.391803
O -2.606514 2.574444 0.411230
O -3.042003 1.842072 -2.025712
O -1.840778 4.210469 -1.351016
O -1.731630 0.448862 1.592923
O -3.197510 2.261113 2.738105
O -4.201807 0.519582 0.976551
N -0.191671 -1.481086 -0.556914
N -2.060194 -0.542945 -1.451561
N -1.322512 -3.189209 0.885212
N -3.760860 -3.055121 0.821696
N -4.957695 -1.466701 -0.479191
C 3.163046 -0.110335 0.012717
C 2.313726 -1.053680 -0.881862
C 2.318119 0.125726 1.285154
C 1.170209 -1.560558 0.031658
C 1.879682 1.566897 1.589843
C -1.312748 -2.142447 0.021058
C -0.704075 -0.511587 -1.441543
C -2.486038 -1.532910 -0.545266
C -3.757380 -1.978382 -0.050127
C -2.585412 -3.601606 1.230364
H 3.490421 0.816570 -0.520116
H 1.992802 -0.548154 -1.818312
H 2.880357 -0.277451 2.174202
H 1.320721 -2.616461 0.392764
H 2.707126 2.281108 1.402048
H 1.578153 1.646554 2.661222
H 3.321240 -2.249907 -2.158133
H -0.075449 0.138335 -2.069222
H 4.091726 -3.450355 -0.065992
H 5.730665 -0.871534 -2.595713
H -2.650817 -4.457761 1.928179
H -4.979450 -0.475943 -0.744124
H -5.789429 -1.750622 0.039171
H -0.178850 4.521604 -0.849416
H -2.691116 0.167279 -1.946831
H -0.820219 0.892245 1.648728
H -3.002032 3.238547 2.632261


%chk=000189064-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000189064

0 1
P 5.357794 -1.916055 -0.438677
P 1.078633 2.816117 -0.578243
P -1.861156 2.897176 -1.730943
P -2.947788 1.801107 1.045310
O 1.050606 -0.818485 1.341492
O 4.107848 -1.291293 0.594234
O 2.624361 -1.889128 -1.763653
O 0.781947 2.014358 0.968834
O 4.762021 -3.443603 -0.884558
O 5.105456 -0.950141 -1.887531
O 6.822717 -1.898005 0.134305
O -0.235475 2.095582 -1.397957
O 0.657883 4.436852 -0.419573
O 2.534631 2.454679 -1.087762
O -2.416941 3.021511 -0.048902
O -2.647051 1.745120 -2.504630
O -1.463136 4.402763 -2.109025
O -1.574311 0.943057 1.454875
O -3.267743 2.732177 2.435377
O -4.134219 0.890469 0.512432
N -0.326285 -1.602477 -0.418871
N -2.250897 -0.761639 -1.159402
N -1.229878 -3.531694 0.861326
N -3.683279 -3.564837 0.921094
N -4.997820 -1.756663 0.123466
C 3.110977 -0.285958 0.156127
C 2.082249 -0.911007 -0.833432
C 2.288756 0.007333 1.434399
C 1.057214 -1.601400 0.091762
C 1.906404 1.465536 1.771963
C -1.364650 -2.413326 0.112116
C -0.907497 -0.633561 -1.188946
C -2.585065 -1.838598 -0.320588
C -3.789859 -2.379019 0.227010
C -2.447486 -4.081116 1.173441
H 3.603025 0.599473 -0.275466
H 1.628072 -0.066723 -1.384762
H 2.886308 -0.365713 2.289296
H 1.329011 -2.650650 0.303759
H 2.791102 2.121248 1.683525
H 1.519732 1.505331 2.802918
H 3.291722 -1.432449 -2.355158
H -0.408672 0.194538 -1.687247
H 3.806534 -3.369595 -1.192590
H 5.916686 -0.509850 -2.246102
H -2.424186 -5.032109 1.712044
H -5.000189 -0.727675 0.044069
H -5.794329 -2.224196 0.558937
H -0.127278 4.718094 -1.038842
H -2.849746 -0.052400 -1.627895
H -0.649843 1.388766 1.344775
H -4.003709 3.390477 2.349271


