%chk=000245179.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245179

0 1
P -0.345506 -0.964681 1.163254
O -0.739903 -0.735298 2.578699
N 0.519427 0.355752 0.356743
N 0.919273 -2.177621 0.880585
C 1.800694 -0.103036 -0.049209
C 2.024359 -1.490132 0.269158
C -1.710872 -1.400199 0.027852
C 0.072459 1.715539 0.327320
C 2.802350 0.636184 -0.674456
C 3.229484 -2.098088 -0.064546
C -1.450123 -1.844101 -1.267677
C -3.013839 -1.271983 0.509468
C 4.009493 0.001820 -1.008011
C 0.146891 2.442117 -0.875816
C -0.482340 2.299273 1.482598
C 4.220976 -1.342875 -0.712539
C -2.525835 -2.165275 -2.104833
C -4.084793 -1.593317 -0.333106
C -0.329581 3.753639 -0.913093
C -0.961723 3.608297 1.418719
C -3.838190 -2.037921 -1.636638
C -0.884478 4.339955 0.228629
H 1.181944 -2.809846 1.654415
H 2.663089 1.693592 -0.889821
H 3.402585 -3.146298 0.170129
H -0.428418 -1.951969 -1.642994
H -3.216590 -0.929916 1.530705
H 0.556323 1.979283 -1.771647
H -0.537873 1.746348 2.425447
H 4.790229 0.579246 -1.501955
H 5.162577 -1.818940 -0.978795
H -2.340648 -2.514129 -3.118835
H -5.107591 -1.497698 0.026388
H -0.272611 4.320238 -1.842061
H -1.394567 4.063922 2.309664
H -4.673546 -2.287438 -2.291101
H -1.255826 5.361359 0.191960


%chk=000245179-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245179

0 1
P -0.267754 -1.024729 1.167943
O -0.678880 -0.914662 2.710842
N 0.671970 0.304965 0.405822
N 1.016179 -2.137783 0.713627
C 1.977180 -0.103791 0.010433
C 2.170395 -1.510349 0.188967
C -1.757383 -1.338944 0.106759
C 0.120579 1.616610 0.257882
C 3.040196 0.699108 -0.451391
C 3.402835 -2.116038 -0.116809
C -1.618147 -1.584275 -1.279036
C -3.029320 -1.331417 0.723484
C 4.277490 0.085064 -0.768091
C 0.289487 2.341135 -0.952407
C -0.647488 2.177933 1.312272
C 4.457222 -1.307536 -0.609965
C -2.771975 -1.823326 -2.056962
C -4.178945 -1.570901 -0.062193
C -0.291448 3.618789 -1.093805
C -1.242455 3.448005 1.149048
C -4.050595 -1.815787 -1.449357
C -1.062129 4.178861 -0.047519
H 1.024400 -3.111620 1.011042
H 2.917542 1.781064 -0.549923
H 3.544442 -3.192879 0.027329
H -0.624991 -1.592044 -1.742260
H -3.098645 -1.144459 1.800691
H 0.849821 1.895270 -1.780224
H -0.760326 1.623622 2.250864
H 5.103242 0.704797 -1.133340
H 5.418900 -1.768340 -0.858987
H -2.675745 -2.014295 -3.131134
H -5.169191 -1.566521 0.405664
H -0.155299 4.170717 -2.030784
H -1.834776 3.871832 1.967578
H -4.943715 -2.001284 -2.056508
H -1.515372 5.169013 -0.164956


