%chk=000285047.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000285047

0 1
P 1.256556 -0.079890 -0.020881
O -1.788120 0.467854 -1.229311
N 0.179824 -0.043784 1.252762
C 2.919523 -0.362540 0.724471
C 0.998246 -1.445744 -1.238972
C 1.402456 1.472602 -1.018639
C 4.068490 -0.266144 -0.064791
C 0.026946 -2.406221 -0.963901
C 2.201913 2.507190 -0.530193
C 2.993504 -0.685402 2.078541
C 1.776435 -1.513205 -2.397035
C 0.680311 1.616184 -2.203084
C -1.186477 0.043282 1.055495
C 5.317000 -0.501413 0.517504
C -0.166437 -3.461324 -1.867767
C 2.295289 3.701459 -1.253849
C 4.250538 -0.918935 2.655504
C 1.579680 -2.567569 -3.293279
C 0.778156 2.813267 -2.923453
C 5.406127 -0.828751 1.877193
C 0.607807 -3.541099 -3.026909
C 1.585589 3.851916 -2.450473
C -2.038787 -0.516655 1.950654
C -1.754368 0.882634 -0.087820
C -3.493871 -0.385347 1.957480
C -2.223008 2.249110 0.294987
C -4.153567 -0.098703 3.169387
C -4.259065 -0.564935 0.790515
C -5.543130 0.018502 3.204998
C -5.649952 -0.446793 0.834601
C -6.296949 -0.152380 2.038277
H 4.020977 -0.007724 -1.124384
H -0.599059 -2.360398 -0.064268
H 2.759438 2.413426 0.405849
H 2.092224 -0.755865 2.704727
H 2.532332 -0.760493 -2.628091
H 0.018349 0.823896 -2.579069
H 6.221176 -0.431715 -0.084150
H -0.926993 -4.213944 -1.663894
H 2.916660 4.514664 -0.883338
H 4.320632 -1.171642 3.712506
H 2.178115 -2.632155 -4.199775
H 0.216193 2.934812 -3.848455
H 6.381867 -1.012955 2.326642
H 0.455012 -4.360492 -3.729087
H 1.659084 4.783026 -3.012133
H -1.621911 -1.101452 2.774529
H -1.457442 2.792131 0.867652
H -2.495955 2.852294 -0.580166
H -3.111798 2.183359 0.946075
H -3.570648 0.035312 4.078027
H -3.766223 -0.810962 -0.149568
H -6.043661 0.243326 4.144877
H -6.231966 -0.587937 -0.074428
H -7.378862 -0.060778 2.069408


%chk=000285047-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000285047

0 1
P 1.173081 -0.084959 -0.286580
O -1.263409 0.493983 -1.462579
N 0.017290 -0.237442 0.956821
C 2.753676 -0.431562 0.664608
C 1.088334 -1.449037 -1.578182
C 1.539726 1.540397 -1.170245
C 4.019565 -0.216911 0.068786
C 0.108583 -2.451836 -1.407226
C 2.162407 2.575194 -0.428335
C 2.663539 -0.955344 1.974312
C 2.004160 -1.518528 -2.653084
C 1.137186 1.768020 -2.508126
C -1.319758 0.158141 0.908528
C 5.196355 -0.523889 0.787975
C 0.040036 -3.526502 -2.320282
C 2.400824 3.829493 -1.032581
C 3.842984 -1.261280 2.689531
C 1.927999 -2.593437 -3.568093
C 1.392227 3.019645 -3.111131
C 5.110362 -1.049164 2.098327
C 0.947516 -3.598495 -3.403138
C 2.021466 4.052104 -2.376923
C -2.054658 0.029890 2.096957
C -1.876197 0.738386 -0.369566
C -3.498836 -0.026919 2.312363
C -2.986225 1.780357 -0.375469
C -4.017044 0.272968 3.612978
C -4.434799 -0.447591 1.314158
C -5.396742 0.209621 3.886030
C -5.816246 -0.505254 1.587713
C -6.310157 -0.171561 2.872021
H 4.098053 0.206763 -0.938987
H -0.588036 -2.384219 -0.564576
H 2.462789 2.402639 0.611558
H 1.666944 -1.097651 2.404356
H 2.766668 -0.743839 -2.792188
H 0.616587 0.984513 -3.064875
H 6.175132 -0.352004 0.326652
H -0.720477 -4.304161 -2.189411
H 2.882640 4.627148 -0.456491
H 3.772355 -1.665421 3.705546
H 2.632979 -2.644475 -4.405255
H 1.085806 3.191748 -4.148799
H 6.023926 -1.288638 2.654434
H 0.891173 -4.431662 -4.112663
H 2.210923 5.023939 -2.846510
H -1.439115 -0.179054 2.982956
H -2.517357 2.743652 -0.657431
H -3.729989 1.545534 -1.156409
H -3.488104 1.898841 0.592559
H -3.317185 0.572670 4.402933
H -4.064041 -0.769907 0.334532
H -5.764082 0.454140 4.889492
H -6.509321 -0.835887 0.805199
H -7.383315 -0.228255 3.085310


