%chk=000164089.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000164089

0 1
 O   -7.103400      0.2315000     -0.1229000    
 O   -5.939300      -2.263900     -0.4974000    
 O    6.861900     -6.4499997E-02 -0.4027000    
 O    5.636800      -2.416000      0.4290000    
 N  -0.7438000      0.8233000      0.5413000    
 N    1.408700     -0.2412000      0.4956000    
 N    3.119300       3.381500     -0.7560000    
 C   -1.395300       1.828400       1.383700    
 C   -2.718800       2.232700      0.7403000    
 C   -1.479900     -0.4297000      0.3326000    
 C   -3.570200       1.030100      0.4323000    
 C   -2.976200     -0.2267000      0.2236000    
 C   0.6310000      0.8780000      0.3122000    
 C   -4.958800       1.172000      0.3030000    
 C   -3.790300      -1.328200     -8.0499999E-02
 C   -5.755900      7.0200004E-02 -4.1999999E-03
 C   -5.172500      -1.179800     -0.1930000    
 C    1.201500       2.087800     -0.1059000    
 C    2.735000     -0.1801000      0.2724000    
 C    3.364900       1.009500     -0.1494000    
 C    2.568600       2.147600     -0.3351000    
 C    3.526700      -1.310400      0.4566000    
 C    4.751900       1.037400     -0.3731000    
 C    4.905700      -1.282900      0.2345000    
 C    5.519400     -0.1078000     -0.1809000    
 C   -7.605800      0.5598000      -1.416600    
 C   -5.262700      -3.506800     -0.6744000    
 C    7.312300     -0.3734000      -1.720700    
 C    4.929300      -3.578500      0.8556000    
 H  -0.7837000       2.725200       1.532400    
 H   -1.566500       1.401200       2.380600    
 H   -2.531200       2.771800     -0.1966000    
 H   -3.250800       2.909400       1.419100    
 H   -1.276000      -1.110100       1.168800    
 H   -1.132700     -0.9030000     -0.5948000    
 H   -5.419800       2.146900      0.4450000    
 H   -3.279700      -2.275600     -0.2215000    
 H   0.5834000       2.966600     -0.2710000    
 H    3.001200      -2.204100      0.7816000    
 H    5.269500       1.935500     -0.6970000    
 H    2.507000       4.178300     -0.8776000    
 H    4.103500       3.496900     -0.9430000    
 H   -7.360300     -0.2271000      -2.136800    
 H   -7.199000       1.518400      -1.753900    
 H   -8.693800      0.6457000      -1.350000    
 H   -4.766700      -3.832000      0.2466000    
 H   -4.578900      -3.476300      -1.529500    
 H   -6.025300      -4.258000     -0.9054000    
 H    8.403400     -0.3029000      -1.735200    
 H    6.905300      0.3422000      -2.442200    
 H    7.023500      -1.392300      -1.997700    
 H    4.474900      -3.436100       1.842100    
 H    5.665600      -4.382400      0.9598000    
 H    4.204300      -3.909200      0.1039000    


%chk=000164089-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000164089

0 1
O -7.049616 0.239918 -0.608508
O -5.826174 -2.300491 -0.224166
O 6.852189 -0.202692 -0.421527
O 5.309571 -2.570957 -0.397485
N -0.738560 1.231821 0.692152
N 1.254773 0.055103 0.342722
N 3.497273 3.677284 0.299544
C -1.543256 2.358645 1.189054
C -2.769505 2.575731 0.278253
C -1.423984 -0.073311 0.676338
C -3.550482 1.278892 0.124719
C -2.904366 0.035097 0.325526
C 0.650200 1.262799 0.520573
C -4.925361 1.290520 -0.214806
C -3.649961 -1.164673 0.204052
C -5.671418 0.105626 -0.352044
C -5.022118 -1.148474 -0.122996
C 1.384544 2.498994 0.510123
C 2.621342 0.036808 0.134744
C 3.447096 1.220198 0.111520
C 2.775314 2.490172 0.313780
C 3.247336 -1.237449 -0.050224
C 4.848012 1.082824 -0.114909
C 4.627694 -1.351403 -0.251297
C 5.448213 -0.164676 -0.299353
C -7.602511 -0.517090 -1.750356
C -5.200912 -3.587117 0.087017
C 7.396830 -0.870078 -1.622429
C 4.517871 -3.797534 -0.272439
H -0.933969 3.272387 1.235513
H -1.889369 2.142189 2.224036
H -2.419949 2.935597 -0.709958
H -3.418977 3.365169 0.703495
H -1.307918 -0.582149 1.661233
H -0.890309 -0.712464 -0.047739
H -5.453886 2.237128 -0.373978
H -3.139667 -2.118951 0.375874
H 0.878467 3.460474 0.632134
H 2.592929 -2.111758 -0.009105
H 5.523679 1.945022 -0.149930
H 3.028675 4.565745 0.451000
H 4.503371 3.683349 0.169877
H -7.492235 -1.602901 -1.595610
H -7.101784 -0.215457 -2.691417
H -8.666430 -0.236585 -1.787863
H -4.809454 -3.601841 1.122672
H -4.382807 -3.822156 -0.621828
H -6.005598 -4.330163 -0.016204
H 8.488776 -0.753286 -1.543377
H 7.030850 -0.370690 -2.541313
H 7.122501 -1.937832 -1.637380
H 4.028767 -3.853896 0.718713
H 5.241114 -4.619272 -0.380956
H 3.750490 -3.863248 -1.067867


