%chk=000206930.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000206930

0 1
P 0.060985 0.021866 -0.864316
O 0.039876 -0.031389 -2.364109
N 1.648521 0.039006 -0.091565
N -0.735246 1.463615 -0.252225
C 2.469341 -1.128756 -0.555740
C 2.364164 1.341064 -0.295835
C -1.033787 1.478049 1.210188
C -1.899849 1.872403 -1.097132
C 3.788648 -1.170600 0.237511
C 3.682355 1.327428 0.500005
C -1.467355 2.897472 1.625488
C -2.332170 3.296570 -0.704085
C 4.564475 0.143628 0.083872
C -2.662586 3.377603 0.791974
C -0.767836 -1.447426 -0.088000
C -0.519532 -1.820594 1.231044
C -1.655516 -2.163153 -0.888825
C -1.189525 -2.927410 1.766589
C -2.325308 -3.269579 -0.349897
C -2.092994 -3.647079 0.976303
H 2.698883 -1.094439 -1.647273
H 1.903897 -2.070588 -0.366458
H 1.719758 2.171753 0.078643
H 2.584709 1.554461 -1.367588
H -0.110510 1.201945 1.771508
H -1.830070 0.753197 1.497714
H -2.769656 1.184010 -0.997527
H -1.587699 1.860884 -2.171438
H 4.400516 -2.024177 -0.106096
H 3.569039 -1.350243 1.308328
H 3.457888 1.262179 1.582755
H 4.217354 2.281935 0.346602
H -0.616765 3.594425 1.488176
H -1.714859 2.910818 2.701884
H -3.202618 3.601999 -1.311958
H -1.515957 4.006496 -0.945303
H 5.483252 0.117957 0.697870
H 4.897390 0.267989 -0.964372
H -3.555195 2.764181 1.017933
H -2.924695 4.415776 1.067381
H 0.196449 -1.276758 1.853334
H -1.831229 -1.885697 -1.934501
H -1.005781 -3.230305 2.794944
H -3.021541 -3.836204 -0.964710
H -2.614119 -4.507210 1.395208


%chk=000206930-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000206930

0 1
P -0.188995 -0.077300 -0.996686
O -0.498880 -0.068562 -2.576846
N 1.465305 0.065319 -0.399260
N -0.944739 1.315743 -0.230319
C 2.377092 -1.097502 -0.562865
C 2.166599 1.366614 -0.564452
C -0.896228 1.526826 1.232915
C -2.110593 1.924451 -0.914724
C 3.489870 -1.039088 0.505727
C 3.271141 1.497564 0.506384
C -0.929718 3.039515 1.552246
C -2.145191 3.443688 -0.644604
C 4.253657 0.304490 0.432200
C -2.139411 3.726267 0.876266
C -0.784665 -1.677724 -0.226809
C -0.538837 -2.016710 1.125898
C -1.566657 -2.525619 -1.046365
C -1.077713 -3.209885 1.657427
C -2.104105 -3.717367 -0.509916
C -1.862138 -4.059428 0.841372
H 2.836355 -1.089813 -1.577934
H 1.799299 -2.033044 -0.467297
H 1.422763 2.176934 -0.475831
H 2.623043 1.434702 -1.578689
H 0.033301 1.075980 1.624406
H -1.758648 1.025736 1.733566
H -3.060565 1.469045 -0.546558
H -2.023032 1.706496 -1.993189
H 4.184455 -1.888850 0.358150
H 3.029074 -1.153691 1.506662
H 2.797684 1.530324 1.507689
H 3.810396 2.453846 0.360573
H 0.008380 3.502530 1.187172
H -0.965404 3.178989 2.650564
H -3.047568 3.877589 -1.117542
H -1.260284 3.912215 -1.117594
H 5.003826 0.368579 1.243101
H 4.811201 0.352910 -0.526384
H -3.078155 3.336653 1.323345
H -2.120278 4.815585 1.070216
H 0.083862 -1.367186 1.751824
H -1.730671 -2.239661 -2.091775
H -0.885017 -3.477383 2.702355
H -2.706086 -4.377961 -1.143682
H -2.278627 -4.984713 1.255565


