%chk=000188955.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188955

0 1
P -4.634291 -0.180514 -0.509999
O -0.843309 0.445511 1.481739
O -3.415954 0.845391 -0.999269
O -4.409422 -0.472796 1.098633
O -4.048234 -1.598554 -1.139732
O -5.983987 0.221582 -0.881085
N 1.043297 0.161485 0.149343
N 2.179945 -1.804710 -0.230949
N 3.011505 1.716634 0.236752
N 5.139539 0.555698 -0.113277
N 5.297296 -1.772620 -0.495550
C -2.149817 0.384836 -0.489751
C -2.223596 0.457788 1.061367
C -0.982705 1.321618 -0.787760
C -0.054388 1.099060 0.432647
C -3.062514 -0.702698 1.587937
C 2.406103 0.493224 0.104342
C 0.974610 -1.263353 -0.048813
C 3.098493 -0.742281 -0.145606
C 4.520670 -0.672951 -0.252239
C 4.367528 1.662524 0.118600
H -1.944381 -0.638603 -0.892015
H -2.649303 1.432366 1.412150
H -1.315965 2.376194 -0.864301
H -0.486557 1.105696 -1.751530
H 0.355328 2.037491 0.882278
H -2.711999 -1.704677 1.279877
H -3.196114 -0.683794 2.689015
H 0.028259 -1.785013 -0.027499
H -4.647486 -2.134070 -1.714095
H 4.914127 2.616823 0.220438
H 6.301006 -1.693743 -0.549890
H 4.876013 -2.685341 -0.578458


%chk=000188955-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188955

0 1
P -4.837556 -0.097634 -0.481309
O -0.788407 0.294742 1.377928
O -3.461803 0.771676 -1.114447
O -4.517885 -0.225810 1.226315
O -4.468683 -1.682179 -1.080914
O -6.255737 0.491228 -0.824607
N 1.146586 0.056257 -0.007198
N 2.390580 -1.800686 -0.532993
N 2.988494 1.657102 0.467597
N 5.203236 0.624964 0.179047
N 5.501224 -1.625087 -0.477193
C -2.191037 0.294069 -0.517473
C -2.199683 0.477222 1.015727
C -0.976075 1.130056 -0.931018
C 0.012313 0.923988 0.267686
C -3.126908 -0.527451 1.702120
C 2.492645 0.438234 0.117116
C 1.152775 -1.298001 -0.394256
C 3.240417 -0.719965 -0.218180
C 4.660359 -0.589182 -0.176276
C 4.357112 1.658052 0.475455
H -2.059423 -0.777151 -0.768918
H -2.543692 1.507105 1.251310
H -1.271788 2.190615 -1.004609
H -0.530416 0.820798 -1.887591
H 0.439500 1.875621 0.628966
H -2.859791 -1.571218 1.454372
H -3.183114 -0.394825 2.792440
H 0.236134 -1.864895 -0.536354
H -5.259507 -2.235087 -1.304937
H 4.837687 2.600962 0.751866
H 6.506719 -1.473495 -0.428603
H 5.119421 -2.531824 -0.737768


