%chk=000026658.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026658

0 1
 O    2.876500      0.1164000       1.753800    
 O    5.425800       2.068200     -0.9726000    
 O    7.217800       1.581200      0.3098000    
 N    4.037800     -2.0500001E-02 -0.2549000    
 C   -3.413400      3.4499999E-02 -0.4002000    
 C   -4.689000      0.1013000      0.4421000    
 C   -2.163600      8.3499998E-02  0.4815000    
 C   -5.973400      4.7699999E-02 -0.3911000    
 C  -0.8879000     -1.6200000E-02 -0.3567000    
 C   -7.284400      8.8100001E-02  0.4015000    
 C   0.3620000      6.5499999E-02  0.5201000    
 C   -8.529700     -2.5599999E-02 -0.4812000    
 C    1.635300     -3.0000001E-04 -0.3202000    
 C    5.374900     -1.3000000E-03  0.2930000    
 C    6.113600      -1.310700     -5.7900000E-02
 C   -9.837600      2.2299999E-02  0.3127000    
 C    2.894300      4.0399998E-02  0.5282000    
 C    6.430700      -1.414000      -1.552300    
 C    5.373900      -2.566100      0.4146000    
 C    6.113100       1.268900     -0.1201000    
 C   -11.07670     -0.1631000     -0.5500000    
 H   -3.413300     -0.8907000     -0.9891000    
 H   -3.398200      0.8703000      -1.110000    
 H   -4.687300       1.025700       1.032800    
 H   -4.695300     -0.7307000       1.156900    
 H   -2.190400     -0.7396000       1.205900    
 H   -2.156500       1.018700       1.054400    
 H   -5.967100      0.8839000      -1.101900    
 H   -5.958300     -0.8695000     -0.9939000    
 H  -0.8862000     -0.9609000     -0.9140000    
 H  -0.8708000      0.7949000      -1.094900    
 H   -7.285100     -0.7299000       1.132300    
 H   -7.327700       1.023300      0.9729000    
 H   0.3550000     -0.7556000       1.247700    
 H   0.3508000      0.9987000       1.096900    
 H   -8.526800      0.7857000      -1.219400    
 H   -8.484600     -0.9662000      -1.044000    
 H    1.665600      0.8427000      -1.020800    
 H    1.649900     -0.9272000     -0.9061000    
 H    5.286800      6.2500000E-02   1.385100    
 H    7.079200      -1.287100      0.4659000    
 H   -9.908800      0.9824000      0.8374000    
 H   -9.825000     -0.7598000       1.081100    
 H    3.938600     -2.9800000E-02  -1.266000    
 H    5.519900      -1.460700      -2.157900    
 H    7.010400      -2.320800      -1.758100    
 H    7.026900     -0.5632000      -1.896700    
 H    4.434900      -2.713900     -0.1289000    
 H    5.991200      -3.457500      0.2592000    
 H    5.144800      -2.501300       1.483400    
 H   -11.14310      0.6216000      -1.310300    
 H   -11.97970     -0.1185000      6.6600002E-02
 H   -11.05740      -1.132600      -1.057500    
 H    5.925400       2.882800      -1.194300    


%chk=000026658-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000026658

0 1
O 2.932502 -1.198415 1.459408
O 5.213476 2.227560 -0.634494
O 6.815504 1.873295 1.008377
N 4.008267 -0.100076 -0.286096
C -3.517274 -0.289487 -0.496360
C -4.767364 0.101327 0.323915
C -2.194084 -0.088906 0.275978
C -6.093696 -0.100753 -0.442789
C -0.941486 -0.486559 -0.537327
C -7.342294 0.284044 0.382824
C 0.370421 -0.299291 0.254635
C -8.670608 0.080917 -0.380281
C 1.624623 -0.691978 -0.561990
C 5.273033 0.034265 0.442344
C 6.377861 -1.002781 0.012602
C -9.918002 0.463123 0.449146
C 2.892039 -0.687934 0.297138
C 6.773411 -0.845807 -1.473262
C 5.907563 -2.440415 0.320125
C 5.849910 1.442732 0.345044
C -11.241266 0.256286 -0.319177
H -3.601895 -1.351589 -0.808544
H -3.491415 0.307994 -1.431950
H -4.683130 1.163398 0.636378
H -4.791119 -0.495729 1.259621
H -2.222696 -0.683434 1.212731
H -2.107987 0.973582 0.585963
H -6.072993 0.499477 -1.376692
H -6.176393 -1.162079 -0.758222
H -1.031432 -1.548045 -0.850939
H -0.906361 0.112533 -1.471828
H -7.361656 -0.315841 1.316958
H -7.259930 1.345499 0.698126
H 0.353034 -0.914383 1.173771
H 0.460230 0.755646 0.583506
H -8.654685 0.682437 -1.313496
H -8.754031 -0.980026 -0.696997
H 1.738532 -0.030788 -1.443496
H 1.487757 -1.722649 -0.948036
H 5.041091 -0.160413 1.508428
H 7.260166 -0.770516 0.642162
H -9.833872 1.523227 0.764946
H -9.932557 -0.137873 1.381458
H 3.909500 0.404347 -1.168384
H 5.909897 -1.047657 -2.134820
H 7.566989 -1.569275 -1.732938
H 7.156771 0.166353 -1.700032
H 5.024000 -2.704415 -0.288872
H 6.711891 -3.161852 0.086181
H 5.626550 -2.558783 1.381150
H -11.265233 0.869954 -1.239671
H -12.116412 0.535945 0.296039
H -11.363466 -0.801615 -0.619698
H 5.646122 3.123325 -0.667764


