%chk=000103512.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000103512

0 1
 P    1.169200      0.4119000     -0.6999000    
 O   0.8874000      7.5000003E-02  -2.143800    
 N   -3.919300      0.5384000      0.5244000    
 C  -0.2030000     -0.3152000      0.2641000    
 C   -1.541300      0.3798000     -3.8400002E-02
 C   -2.675300     -0.1465000      0.8427000    
 C   -5.032500      9.1899998E-02   1.361400    
 C   -4.355700      0.2937000     -0.8500000    
 C   -6.250300      0.6228000      0.6197000    
 C   -5.806600      0.7520000     -0.8342000    
 C  -0.3195000      -1.812200      5.7599999E-02
 C    1.156600       2.150300     -0.3404000    
 C    2.701300     -0.2616000     -0.1121000    
 C   0.4664000      -2.659800      0.8170000    
 C   -1.209200      -2.294700     -0.8849000    
 C    1.661800       3.050100      -1.272300    
 C    3.021900     -0.1716000       1.238500    
 C   0.6409000       2.598900      0.8705000    
 C    3.572300     -0.8763000      -1.006000    
 C   0.3591000      -4.037500      0.6271000    
 C   -1.316500      -3.672500      -1.074600    
 C    1.651400       4.416100     -0.9896000    
 C    4.226500     -0.7017000       1.700500    
 C   0.6304000       3.964900       1.153000    
 C    4.776900      -1.406500     -0.5439000    
 C  -0.5324000      -4.543800     -0.3185000    
 C    1.135700       4.873400      0.2229000    
 C    5.104000      -1.319100      0.8094000    
 H   1.0500000E-02 -0.1618000       1.329000    
 H   -1.467400       1.455200      0.1407000    
 H   -1.758700      0.3161000      -1.109000    
 H   -2.817200      -1.228000      0.7657000    
 H   -2.417800      5.8400001E-02   1.890000    
 H   -4.972700      0.4941000       2.377600    
 H   -5.085200      -1.002900       1.421100    
 H   -4.307400     -0.7707000      -1.112800    
 H   -3.792500      0.8680000      -1.591400    
 H   -7.108500     -4.8599999E-02  0.7238000    
 H   -6.543600       1.605900       1.006500    
 H   -5.890000       1.797100      -1.155200    
 H   -6.426200      0.1451000      -1.502100    
 H    1.148100      -2.284600       1.572100    
 H   -1.813400      -1.667500      -1.528500    
 H    2.066800       2.699700      -2.216900    
 H    2.348200      0.3043000       1.943600    
 H   0.2747000       1.924100       1.634200    
 H    3.329900     -0.9496000      -2.061500    
 H   0.9664000      -4.716100       1.218900    
 H   -2.004100      -4.067300      -1.817100    
 H    2.045800       5.123300      -1.713300    
 H    4.480800     -0.6344000       2.754200    
 H   0.2369000       4.320900       2.100600    
 H    5.460300      -1.887200      -1.237700    
 H  -0.6152000      -5.616500     -0.4670000    
 H    1.129500       5.936800      0.4439000    
 H    6.041900      -1.732100       1.169100    


%chk=000103512-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000103512

0 1
P 1.117516 0.494703 -0.699236
O 0.909287 0.345234 -2.301440
N -4.072695 0.509781 0.399778
C -0.288880 -0.328434 0.323300
C -1.633674 0.305846 -0.118932
C -2.821970 -0.207411 0.721568
C -5.203120 0.183276 1.308750
C -4.607991 0.268850 -0.967462
C -6.433445 0.813793 0.608339
C -6.045725 0.849942 -0.910209
C -0.228496 -1.840277 0.166148
C 1.141532 2.298238 -0.183940
C 2.725238 -0.298688 -0.155298
C -0.009328 -2.671534 1.293346
C -0.402122 -2.445064 -1.108591
C 1.240508 3.244844 -1.230627
C 3.254677 -0.177162 1.150146
C 1.059762 2.727447 1.161821
C 3.408891 -1.049221 -1.139501
C 0.022989 -4.077935 1.160220
C -0.367451 -3.849876 -1.241661
C 1.270360 4.624494 -0.927414
C 4.472197 -0.818069 1.473220
C 1.088187 4.108534 1.460653
C 4.625727 -1.688180 -0.812140
C -0.159595 -4.672495 -0.109171
C 1.197627 5.057279 0.417232
C 5.157206 -1.574681 0.493470
H -0.082737 -0.062092 1.379034
H -1.589470 1.406763 -0.014983
H -1.794352 0.088458 -1.191200
H -2.932761 -1.313397 0.579566
H -2.604138 -0.038837 1.795736
H -5.019146 0.592214 2.318824
H -5.343488 -0.925102 1.408078
H -4.639041 -0.827500 -1.202159
H -3.981538 0.759362 -1.731898
H -7.349090 0.226240 0.796199
H -6.606540 1.837184 0.982548
H -6.057562 1.887804 -1.284113
H -6.738977 0.260567 -1.535469
H 0.133592 -2.215105 2.281171
H -0.533714 -1.808849 -1.991268
H 1.279825 2.883138 -2.264890
H 2.741193 0.416725 1.915113
H 0.956194 2.005160 1.980674
H 2.975890 -1.113426 -2.144694
H 0.189958 -4.706329 2.042522
H -0.496872 -4.304300 -2.230647
H 1.346621 5.358769 -1.736862
H 4.886610 -0.724592 2.483205
H 1.020885 4.442881 2.501778
H 5.156561 -2.271758 -1.572296
H -0.135738 -5.762976 -0.215480
H 1.219268 6.127623 0.651107
H 6.101455 -2.069960 0.746733


