%chk=000239708.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239708

0 1
P -0.094848 0.046101 0.456341
O -0.308382 -0.272161 1.910801
N -0.166570 -1.354958 -0.610107
N -1.316944 1.144243 -0.204127
C -0.694407 -2.641891 -0.041405
C -2.541081 1.404613 0.624610
C -1.484284 -1.875174 -1.088120
C -1.506534 2.496465 0.401876
C 0.077657 -3.891922 -0.418445
C -3.856496 1.405371 -0.129082
C 1.510458 0.833836 0.043497
C 1.027692 -4.310377 0.699552
C -4.505166 0.024597 -0.092866
C 1.841236 1.106493 -1.282307
C 2.377871 1.134843 1.093044
C 3.074124 1.710076 -1.563211
C 3.608071 1.738019 0.805355
C 3.952016 2.024369 -0.520614
H -1.070574 -2.667685 0.999533
H -2.623141 0.962166 1.637241
H -1.485467 -2.198640 -2.134773
H -2.439734 -1.387544 -0.836518
H -1.687389 3.295542 -0.325708
H -0.897303 2.860066 1.233612
H 0.653207 -3.721384 -1.353582
H -0.640520 -4.705867 -0.642642
H -3.698084 1.717696 -1.183405
H -4.530291 2.163809 0.317892
H 1.732995 -3.503218 0.940558
H 0.491669 -4.556702 1.623436
H 1.617067 -5.187958 0.412986
H -3.820556 -0.741706 -0.498548
H -4.768351 -0.278156 0.927255
H -5.421489 -0.000881 -0.692662
H 1.164539 0.857139 -2.104543
H 2.118496 0.905853 2.132627
H 3.349263 1.930312 -2.592398
H 4.297088 1.980218 1.611686
H 4.910665 2.492695 -0.742137


%chk=000239708-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239708

0 1
P -0.392621 0.235503 0.909937
O -0.564515 0.210217 2.518184
N -0.827163 -1.290119 0.055850
N -1.425135 1.383692 0.000440
C -0.353520 -2.594930 0.692692
C -2.886871 1.516707 0.408486
C -1.812855 -2.201280 0.781248
C -1.905079 2.622206 0.742953
C 0.158444 -3.647165 -0.276186
C -3.874538 1.597697 -0.742866
C 1.324871 0.622229 0.346747
C 1.618534 -3.385547 -0.706690
C -4.178341 0.202664 -1.333306
C 1.615895 0.812926 -1.024205
C 2.337819 0.719522 1.328171
C 2.943426 1.099111 -1.413995
C 3.663077 1.006100 0.929875
C 3.965524 1.193754 -0.439271
H 0.213182 -2.490536 1.631153
H -3.203517 0.902804 1.266076
H -2.546400 -2.673416 0.119630
H -2.180422 -1.868629 1.761008
H -1.883704 3.535185 0.138981
H -1.609533 2.730366 1.794796
H -0.499856 -3.660573 -1.165365
H 0.075066 -4.641659 0.207543
H -3.452245 2.253677 -1.527101
H -4.807305 2.075757 -0.380855
H 1.703734 -2.400468 -1.198999
H 2.300271 -3.388695 0.164473
H 1.969855 -4.157951 -1.414615
H -3.242441 -0.274839 -1.674212
H -4.643856 -0.457448 -0.576577
H -4.870362 0.273210 -2.191751
H 0.812693 0.747219 -1.765006
H 2.076127 0.578993 2.383333
H 3.179986 1.250200 -2.472893
H 4.454511 1.085097 1.683123
H 4.993766 1.416719 -0.746105


