%chk=000180690.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180690

0 1
P 1.826802 -0.357557 1.726477
O 0.120054 -0.432889 1.706188
O 1.971243 0.600964 3.033102
O 2.487143 -1.666574 1.860861
O -2.736837 0.827573 -0.768589
O -0.586327 1.386862 -0.406053
N 2.173775 0.576205 0.321958
C 3.765175 0.914288 -1.519346
C 2.942816 -0.129911 -0.743941
C 4.606131 0.249705 -2.616420
C 5.424488 1.276794 -3.395349
C -0.471122 -1.374285 0.911873
C -1.330200 -0.909849 -0.106654
C 1.657534 2.020122 2.936762
C -3.054758 2.225668 -1.152046
C -0.313374 -2.749801 1.162505
C -2.078221 -1.853349 -0.836570
C -1.450488 0.527719 -0.412079
C -1.045876 -3.659039 0.406790
C -1.933590 -3.214553 -0.587572
C 0.189038 2.268887 2.663632
C -2.626216 2.419267 -2.595831
C -4.555784 2.288683 -0.931286
H 3.095402 1.677250 -1.960287
H 4.419437 1.467441 -0.816265
H 2.272449 -0.679584 -1.443837
H 3.629891 -0.889813 -0.296915
H 5.284140 -0.503709 -2.167799
H 3.949616 -0.309199 -3.311901
H 1.413020 1.180915 -0.071901
H 4.783045 2.018096 -3.885258
H 6.025093 0.795024 -4.175166
H 6.114395 1.822597 -2.741123
H 2.325778 2.495033 2.193994
H 1.952256 2.343775 3.958254
H -2.493134 2.891444 -0.459418
H 0.380933 -3.090467 1.937524
H -2.772821 -1.497225 -1.602170
H -0.933092 -4.729304 0.591553
H -2.509263 -3.938834 -1.160613
H -3.044013 1.645061 -3.251230
H -2.949852 3.391559 -2.984462
H -1.531813 2.372052 -2.691377
H -5.087998 1.560894 -1.558521
H -4.813976 2.051209 0.109857
H -4.951640 3.283945 -1.161778
H -0.120358 3.261806 3.007278
H -0.444308 1.528894 3.180195
H -0.069894 2.199212 1.593656


%chk=000180690-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180690

0 1
P 1.890772 -0.620004 1.262547
O 0.130138 -0.582708 1.554404
O 2.359714 0.506146 2.482300
O 2.643910 -2.003150 1.451334
O -3.063041 0.696949 -0.803935
O -0.773174 1.050680 -0.662041
N 1.898036 0.069039 -0.298012
C 3.966285 1.063391 -1.371992
C 2.989604 -0.130516 -1.271327
C 5.063227 0.828921 -2.434941
C 6.047156 2.013300 -2.550783
C -0.732225 -1.525977 0.970840
C -1.748112 -1.087384 0.070482
C 2.089602 1.965988 2.335220
C -3.228372 2.050385 -1.459159
C -0.661133 -2.880196 1.371484
C -2.723830 -2.027394 -0.363036
C -1.773893 0.300384 -0.471037
C -1.615959 -3.802447 0.896849
C -2.659074 -3.374735 0.039570
C 0.717462 2.353720 2.892090
C -2.971553 1.902380 -2.965454
C -4.649439 2.492617 -1.106215
H 3.397234 1.982694 -1.619174
H 4.435113 1.232674 -0.381627
H 2.531335 -0.321858 -2.261947
H 3.544010 -1.047790 -0.993991
H 5.624217 -0.094304 -2.184211
H 4.586631 0.646517 -3.420133
H 1.025086 0.554395 -0.574033
H 5.518025 2.943390 -2.832286
H 6.822753 1.821266 -3.314804
H 6.559738 2.197397 -1.587972
H 2.194129 2.253399 1.269941
H 2.908784 2.427221 2.912816
H -2.471240 2.717703 -1.007929
H 0.138839 -3.186053 2.052473
H -3.518217 -1.682064 -1.030598
H -1.552565 -4.851276 1.206255
H -3.410139 -4.088211 -0.314108
H -3.681298 1.184210 -3.412989
H -3.106388 2.879004 -3.465339
H -1.941624 1.558475 -3.158758
H -5.392896 1.787776 -1.518098
H -4.785482 2.543897 -0.012800
H -4.845439 3.493631 -1.531121
H 0.600984 3.454100 2.855975
H 0.619315 2.026933 3.941309
H -0.092307 1.890489 2.304662


