%chk=000036734.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036734

0 1
 O  -0.9782000      0.5410000     -6.0899999E-02
 N   -2.979300      -1.456400     -7.2400004E-02
 C   0.3827000       1.001200     -6.2500000E-02
 C   0.5941000       1.797000      -1.371300    
 C   0.5310000       1.929400       1.161900    
 C  -0.3077000       3.031300      -1.452600    
 C  -0.3625000       3.169200       1.067800    
 C  -0.1346000       3.931500     -0.2334000    
 C    1.344800     -0.1832000      5.0799999E-02
 C    1.348200      -1.200400     -0.9044000    
 C   -1.286600     -0.1630000       1.133300    
 C    2.229000     -0.2375000       1.128800    
 C   -2.741600     -0.6007000       1.080600    
 C    2.234800      -2.270300     -0.7816000    
 C   0.4116000      -1.164700      -2.067100    
 C    3.115400      -1.307500       1.251600    
 C    3.118200      -2.323900      0.2964000    
 C   -4.389900      -1.844600     -0.1476000    
 C   -2.129400      -2.648300     -1.7400000E-02
 H   0.3745000       1.229400      -2.273100    
 H    1.643200       2.112700      -1.445600    
 H    1.557800       2.326100       1.182300    
 H   0.3818000       1.465600       2.141100    
 H   -1.356900       2.723100      -1.537100    
 H  -7.0600003E-02   3.598100      -2.360400    
 H  -0.1545000       3.832600       1.915500    
 H   -1.417500       2.881400       1.146000    
 H   0.8763000       4.357400     -0.2353000    
 H  -0.8342000       4.772700     -0.2945000    
 H  -0.6218000      -1.005800       1.337900    
 H   -1.255400      0.4946000       2.005100    
 H    2.294400      0.5064000       1.912700    
 H   -3.012300      -1.100700       2.019500    
 H   -3.367900      0.2962000      0.9899000    
 H    2.250100      -3.068300      -1.519300    
 H   0.8916000     -0.6811000      -2.923800    
 H   0.1922000      -2.192700      -2.385400    
 H  -0.5682000     -0.7285000      -1.886300    
 H    3.804100      -1.350500       2.090400    
 H    3.808800      -3.156800      0.3919000    
 H   -4.576700      -2.444700      -1.045100    
 H   -4.707100      -2.422900      0.7278000    
 H   -5.028900     -0.9579000     -0.2260000    
 H   -1.067800      -2.428700     -0.1176000    
 H   -2.279700      -3.216700      0.9082000    
 H   -2.363600      -3.314200     -0.8569000    


%chk=000036734-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000036734

0 1
O -0.951020 0.682510 -0.032256
N -2.824735 -1.822977 -0.028234
C 0.480038 1.117638 0.012782
C 0.669176 1.975029 -1.274533
C 0.690751 2.054495 1.241691
C -0.278130 3.196449 -1.318847
C -0.285908 3.252574 1.225273
C -0.118169 4.087989 -0.065848
C 1.418955 -0.115101 -0.003128
C 1.218675 -1.221561 -0.901145
C -1.414918 -0.075272 1.136424
C 2.540516 -0.151429 0.869401
C -2.819920 -0.606132 0.818903
C 2.157106 -2.288849 -0.871897
C 0.048520 -1.362857 -1.864062
C 3.460402 -1.222092 0.879670
C 3.267616 -2.304786 -0.001903
C -4.070456 -1.973740 -0.806745
C -2.489330 -3.047356 0.726112
H 0.518205 1.348938 -2.169324
H 1.725055 2.311273 -1.292913
H 1.723890 2.452301 1.212839
H 0.593697 1.486908 2.187089
H -1.320571 2.832743 -1.381787
H -0.075802 3.783976 -2.235766
H -0.109932 3.883311 2.118540
H -1.328072 2.883355 1.283398
H 0.890505 4.552609 -0.070478
H -0.853545 4.915529 -0.086661
H -0.710669 -0.900294 1.370517
H -1.474704 0.589108 2.025892
H 2.710144 0.675041 1.565081
H -3.363442 -0.782050 1.783751
H -3.359553 0.196028 0.282536
H 2.004009 -3.130623 -1.558677
H -0.098783 -0.470868 -2.495236
H 0.216786 -2.227430 -2.531931
H -0.908970 -1.510407 -1.324777
H 4.312884 -1.205885 1.568172
H 3.967617 -3.148077 -0.015468
H -3.984938 -2.849296 -1.475613
H -4.980658 -2.118319 -0.170347
H -4.226934 -1.078570 -1.433786
H -1.512635 -2.932516 1.227504
H -3.251525 -3.302322 1.506611
H -2.409531 -3.902097 0.031076


