%chk=000279200.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279200

0 1
P -0.163268 -1.311652 -0.359784
O -0.274781 -1.636532 1.091902
O 6.227138 -0.786367 0.601434
O -6.635836 -0.348277 0.564352
O 0.905544 5.022345 -2.473367
O 0.534066 5.395945 -0.375549
N 1.124427 -2.112508 -1.267207
N -1.567369 -1.782719 -1.308953
N 0.648867 4.655845 -1.338065
C 0.112616 0.495386 -0.702740
C 2.426049 -1.808287 -0.695703
C -2.841608 -1.388104 -0.765278
C -0.017418 1.364130 0.377482
C 0.419337 0.949378 -1.984216
C 0.157547 2.739422 0.174430
C 0.597503 2.319795 -2.198079
C 0.461496 3.198279 -1.113020
C 2.877019 -2.364721 0.511672
C -3.224248 -1.807445 0.521765
C 3.257557 -0.938632 -1.433682
C -3.738631 -0.643851 -1.563409
C 4.149955 -2.055505 0.996725
C -4.486674 -1.478394 1.018852
C 4.522514 -0.620323 -0.962012
C -5.000421 -0.322029 -1.082200
C 4.961349 -1.184304 0.257075
C -5.365632 -0.741728 0.214431
C 6.794622 -1.283438 1.858497
C -7.134133 -0.726899 1.888098
C 8.159812 -0.626972 1.898807
C -8.528177 -0.131693 1.912192
H 1.000285 -3.141166 -1.383207
H -1.510445 -1.661046 -2.335823
H -0.248638 0.996297 1.386763
H 0.537085 0.261445 -2.826211
H 0.061598 3.448956 1.003101
H 0.840868 2.711858 -3.190748
H 2.233533 -3.031308 1.091854
H -2.534237 -2.384607 1.149127
H 2.901149 -0.523480 -2.377102
H -3.449305 -0.322890 -2.562509
H 4.483941 -2.488030 1.934214
H -4.764359 -1.802579 2.017125
H 5.185110 0.049414 -1.506973
H -5.711318 0.245741 -1.679138
H 6.139673 -0.963165 2.686786
H 6.848679 -2.384000 1.803433
H -7.137083 -1.828067 1.957619
H -6.467780 -0.288160 2.650322
H 8.076269 0.469199 1.879445
H 8.713449 -0.909883 2.801255
H 8.764407 -0.908158 1.024773
H -9.035016 -0.337790 2.861381
H -9.147559 -0.535113 1.098622
H -8.498428 0.957885 1.769644


%chk=000279200-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000279200

0 1
P -0.285666 -0.747220 0.137671
O -0.606325 -0.945887 1.695284
O 6.511493 -1.605003 0.019280
O -7.213033 -0.986708 0.180140
O 2.008214 5.344810 -1.993391
O 1.170534 5.924826 0.048752
N 0.883868 -1.751005 -0.685904
N -1.648128 -1.137454 -0.905918
N 1.430502 5.059267 -0.873673
C 0.312107 0.993050 -0.185120
C 2.299449 -1.707572 -0.454130
C -3.035594 -1.089653 -0.563472
C 0.034413 1.969597 0.801344
C 0.958137 1.345696 -1.394205
C 0.399128 3.312229 0.580109
C 1.331095 2.683202 -1.625502
C 1.040249 3.646135 -0.633167
C 2.839021 -1.198644 0.751227
C -3.501944 -1.358637 0.748126
C 3.183266 -2.179697 -1.461625
C -3.979991 -0.786926 -1.583830
C 4.236997 -1.129458 0.942434
C -4.884097 -1.320335 1.033667
C 4.573998 -2.144351 -1.263197
C -5.357265 -0.775170 -1.306143
C 5.110979 -1.607511 -0.064879
C -5.819333 -1.035294 0.007907
C 7.124865 -1.058841 1.246627
C -7.744463 -1.236283 1.534030
C 8.636989 -1.166834 1.071013
C -9.262924 -1.110777 1.442566
H 0.502420 -2.621201 -1.069733
H -1.446288 -1.105430 -1.909821
H -0.450614 1.662658 1.734168
H 1.189410 0.576396 -2.138179
H 0.203301 4.093602 1.318802
H 1.840896 2.991919 -2.541502
H 2.167919 -0.881526 1.557763
H -2.781646 -1.586856 1.538891
H 2.777847 -2.569795 -2.402468
H -3.633862 -0.560944 -2.600533
H 4.621904 -0.725501 1.882980
H -5.212794 -1.527026 2.056368
H 5.264607 -2.513104 -2.027720
H -6.089955 -0.553234 -2.087901
H 6.808784 -0.003242 1.378151
H 6.778327 -1.644127 2.123434
H -7.443512 -2.250962 1.868129
H -7.320419 -0.492538 2.240262
H 8.968637 -0.591029 0.190304
H 9.151875 -0.769020 1.964321
H 8.939045 -2.218837 0.932165
H -9.719559 -1.289301 2.433091
H -9.671961 -1.847340 0.730139
H -9.549802 -0.101618 1.101069


