%chk=000225300.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225300

0 1
P 0.431351 1.106306 0.901957
O 0.943717 -0.465490 0.782368
O 1.178860 1.855670 -0.382240
O 0.728005 1.659684 2.236894
N -4.545759 0.707657 1.040794
C -1.321102 1.131373 0.266386
C -2.158772 0.172224 1.102484
C 0.959034 -1.059272 -0.543095
C 2.461042 2.473848 -0.095678
C 2.025914 -2.149376 -0.431723
C 3.578668 1.437587 -0.217264
C 2.101204 -2.990878 -1.709959
C 4.952864 2.119657 -0.232175
C -3.524110 0.004413 0.478336
C 3.170449 -4.074982 -1.601407
C 6.083184 1.099577 -0.342858
C -3.720606 -0.841948 -0.633235
C -5.002772 -0.958248 -1.171717
C -5.787414 0.582636 0.503640
C -6.058198 -0.238337 -0.602128
H -1.351175 0.884197 -0.812051
H -1.729836 2.163729 0.336606
H -1.682979 -0.828795 1.207271
H -2.275082 0.559166 2.146382
H -0.047260 -1.480091 -0.727248
H 1.213219 -0.312516 -1.320233
H 2.515254 3.242847 -0.892233
H 2.448448 2.971493 0.894595
H 1.805332 -2.787471 0.448995
H 3.007548 -1.687102 -0.205891
H 3.435011 0.840570 -1.139455
H 3.531571 0.708511 0.618139
H 2.317781 -2.340328 -2.580484
H 1.117751 -3.458524 -1.914878
H 5.012749 2.835613 -1.075585
H 5.083803 2.720953 0.690238
H 2.968741 -4.760134 -0.769294
H 3.220022 -4.676477 -2.516260
H 4.166138 -3.647061 -1.435846
H 6.006327 0.506678 -1.261203
H 7.061770 1.593429 -0.351609
H 6.078899 0.399494 0.501262
H -2.887152 -1.393557 -1.057273
H -5.181217 -1.606407 -2.029581
H -6.578406 1.166408 0.989377
H -7.065116 -0.312325 -1.002721


%chk=000225300-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225300

0 1
P 0.551509 0.964354 1.097369
O 1.135669 -0.622615 0.645970
O 1.273462 2.085307 -0.029170
O 0.863817 1.251332 2.630648
N -3.262985 -0.594224 -0.882254
C -1.220468 1.024230 0.522363
C -2.082388 -0.068030 1.199809
C 1.065261 -1.049307 -0.780047
C 2.570861 2.710516 0.356251
C 1.787942 -2.394914 -0.874894
C 3.769170 1.825246 -0.013475
C 1.767344 -2.958882 -2.315720
C 5.112775 2.509807 0.334168
C -3.386714 -0.275588 0.447044
C 2.480623 -4.324012 -2.423721
C 6.331970 1.639187 -0.039362
C -4.651331 -0.165609 1.076209
C -5.822203 -0.394101 0.317735
C -4.399106 -0.812038 -1.602607
C -5.698218 -0.725569 -1.050167
H -1.220618 0.877872 -0.570674
H -1.595693 2.038886 0.738977
H -1.524781 -1.025329 1.196000
H -2.277170 0.190669 2.254710
H 0.003006 -1.149960 -1.086079
H 1.551824 -0.284447 -1.417239
H 2.580942 3.660278 -0.206271
H 2.556986 2.926486 1.442838
H 1.305367 -3.110277 -0.181697
H 2.831982 -2.268187 -0.529833
H 3.735612 1.598425 -1.097573
H 3.692559 0.861192 0.526989
H 2.249283 -2.234528 -3.003659
H 0.716853 -3.062230 -2.655985
H 5.178785 3.484606 -0.191011
H 5.139203 2.734600 1.419516
H 1.999361 -5.074944 -1.769631
H 2.455579 -4.710612 -3.459004
H 3.540464 -4.243156 -2.117764
H 6.348322 1.422491 -1.124172
H 7.281009 2.143316 0.219458
H 6.305114 0.672059 0.496521
H -4.711750 0.092660 2.138482
H -6.809463 -0.313969 0.785088
H -4.254297 -1.065660 -2.659343
H -6.577769 -0.910932 -1.674395


