%chk=000194498.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194498

0 1
P 1.143112 2.832215 -0.541703
P 2.216974 -2.043281 1.386313
P 3.635992 1.421239 0.772873
P 3.944105 -1.629407 -1.153450
O -1.479511 -0.799488 -1.331712
O 0.941179 1.235650 -0.872632
O -1.083597 2.512517 -0.798898
O 0.647562 -1.610158 1.477070
O 2.614329 2.558711 0.285112
O 0.371627 3.248503 0.856755
O 1.301887 3.777793 -1.626542
O -3.918401 2.080719 0.388884
O 2.697787 -1.516281 -0.094717
O 2.071237 -3.633136 1.004009
O 2.993219 -1.728787 2.598804
O 2.725551 0.297251 1.552066
O 4.010125 0.571187 -0.609625
O 4.807653 1.882597 1.505869
O 5.379825 -1.465020 -0.394000
O 4.000611 -3.290562 -1.103647
O 3.659241 -0.950837 -2.417224
N -3.496814 -0.052156 -0.365768
N -5.543238 0.492828 0.863570
N -7.107755 -1.168226 1.319092
C 0.010188 0.559721 -0.008153
C -1.358358 1.279178 -0.099331
C -0.186570 -0.817252 -0.661614
C -2.229699 0.391252 -1.025408
C -0.219118 -1.957039 0.371229
C -3.911817 -1.367451 -0.495652
C -4.358148 0.951761 0.336575
C -5.100335 -1.781476 0.049887
C -5.913150 -0.811831 0.740299
H 0.424622 0.509985 1.032054
H -1.812977 1.500387 0.891820
H 0.548367 -0.987494 -1.488897
H -2.452049 0.875758 -2.009700
H 0.036988 -2.938893 -0.071405
H -1.211818 -2.031177 0.864387
H -1.613918 3.253276 -0.361842
H -3.255344 -2.061142 -1.047574
H -5.425593 -2.811600 -0.041872
H 0.934900 3.657376 1.573144
H 2.698931 -4.025226 0.326467
H -7.475347 -2.098265 1.237514
H -7.678366 -0.472173 1.781061
H 3.082223 0.016471 2.521460
H 3.599653 0.868495 -1.507255
H 5.791631 -0.551051 -0.327231
H 4.900203 -3.708561 -1.060762


%chk=000194498-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000194498

0 1
P 0.726697 2.963540 0.283128
P 2.868573 -2.174224 1.278188
P 3.739811 2.114882 -0.069891
P 3.922034 -2.602808 -1.650500
O -1.490442 -1.151101 -0.588847
O 0.728822 1.219145 -0.255758
O -1.385530 2.184923 0.915553
O 1.246141 -2.137270 1.795108
O 2.431344 3.163855 -0.337751
O 1.050172 2.875986 1.951917
O -0.039276 4.129313 -0.441259
O -3.760052 2.287331 0.035616
O 2.677068 -2.244367 -0.435956
O 3.461016 -3.690046 1.728796
O 3.689134 -0.935971 1.841844
O 3.321619 1.544860 1.488851
O 3.239287 0.759748 -1.091142
O 5.208897 2.571715 -0.378108
O 4.482079 -1.112917 -2.076482
O 5.031713 -3.247365 -0.448078
O 3.450061 -3.632576 -2.741255
N -3.578735 -0.026496 -0.287982
N -5.737779 1.051446 -0.133286
N -7.688283 -0.190183 -0.279458
C 0.044631 0.272546 0.654709
C -1.411506 0.752674 0.856672
C -0.091943 -1.085131 -0.059457
C -2.112209 0.166458 -0.405829
C 0.087372 -2.309311 0.874041
C -4.175550 -1.263200 -0.437870
C -4.376824 1.175740 -0.119294
C -5.551543 -1.384358 -0.423600
C -6.318809 -0.167198 -0.276985
H 0.598257 0.215198 1.605618
H -1.845247 0.304006 1.771836
H 0.598910 -1.158832 -0.914831
H -1.911245 0.823244 -1.276948
H 0.200186 -3.232730 0.282115
H -0.761967 -2.405343 1.568773
H -2.293124 2.525278 0.549750
H -3.497974 -2.107257 -0.574000
H -6.021900 -2.362040 -0.540686
H 1.976901 2.472551 2.108890
H 4.276515 -3.909106 1.174350
H -8.214476 -1.053723 -0.384259
H -8.180071 0.697579 -0.179394
H 3.553881 0.551587 1.723069
H 2.225545 0.720473 -1.081944
H 3.976488 -0.225255 -1.682954
H 5.989130 -3.268372 -0.695318


