%chk=000143087.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000143087

0 1
 O   0.9826000      -1.847200     -0.1157000    
 N   -5.209000     -0.2772000     -0.6152000    
 C    6.844900      0.3069000      0.3504000    
 C    8.189900      0.2068000     -0.3747000    
 C    5.733200     -0.5080000     -0.3141000    
 C    9.319100      0.9614000      0.3305000    
 C    4.406600     -0.3474000      0.4329000    
 C    10.65240      0.7676000     -0.3959000    
 C    3.299900      -1.186000     -0.2134000    
 C    11.78970       1.488600      0.3273000    
 C    1.976800      -1.067800      0.5334000    
 C    13.12150       1.270400     -0.3729000    
 C  -0.3125000      -1.409300     -1.2500000E-02
 C   -1.211900      -1.676100      -1.037800    
 C  -0.7123000     -0.7053000       1.117300    
 C   -2.939300     -0.5251000      0.1984000    
 C   -2.530100      -1.232300     -0.9322000    
 C   -2.030600     -0.2616000       1.223100    
 C   -4.313900     -6.2700003E-02  0.3097000    
 C   -6.498200      0.2266000     -0.3727000    
 C   -9.051700       1.223800      0.1059000    
 C   -6.826700       1.512800     -0.7896000    
 C   -7.437000     -0.5647000      0.2818000    
 C   -8.106600       2.012700     -0.5497000    
 C   -8.717000     -6.4999998E-02  0.5216000    
 C   -10.41980       1.758200      0.3641000    
 H    6.544800       1.361000      0.3992000    
 H    6.969500     -3.4600001E-02   1.385600    
 H    8.465700     -0.8516000     -0.4632000    
 H    8.078000      0.5907000      -1.396200    
 H    6.020000      -1.566300     -0.3366000    
 H    5.611500     -0.1830000      -1.354400    
 H    9.408400      0.6021000       1.362800    
 H    9.073500       2.028900      0.3790000    
 H    4.111800      0.7089000      0.4387000    
 H    4.534000     -0.6546000       1.478000    
 H    10.57050       1.144100      -1.422700    
 H    10.88190     -0.3030000     -0.4617000    
 H    3.155800     -0.8789000      -1.256900    
 H    3.597900      -2.241300     -0.2510000    
 H    11.86420       1.126500       1.359300    
 H    11.57840       2.563100      0.3747000    
 H    2.097300      -1.428000       1.561900    
 H    1.706700     -3.7000000E-03  0.5531000    
 H    13.92030       1.795700      0.1599000    
 H    13.37780      0.2066000     -0.4061000    
 H    13.09150       1.649200      -1.399500    
 H  -0.8968000      -2.226800      -1.919600    
 H  -4.4799998E-02 -0.5052000       1.949700    
 H   -3.216200      -1.452200      -1.745700    
 H   -2.336800      0.2825000       2.113000    
 H   -4.581300      0.4913000       1.229500    
 H   -6.096500       2.133900      -1.301400    
 H   -7.184600      -1.569900      0.6088000    
 H   -8.354700       3.019000     -0.8767000    
 H   -9.444000     -0.6885000       1.035000    
 H   -11.16490      0.9553000      0.3588000    
 H   -10.71670       2.475300     -0.4087000    
 H   -10.45020       2.258700       1.337000    


%chk=000143087-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000143087

0 1
O 0.978959 -0.641276 -0.728055
N -5.489094 -0.350504 -0.234218
C 7.155380 0.467460 0.248641
C 8.517382 -0.048220 -0.268130
C 5.946316 -0.226079 -0.417717
C 9.726054 0.641693 0.403537
C 4.586275 0.292089 0.101913
C 11.089691 0.128388 -0.111366
C 3.383426 -0.415342 -0.563520
C 12.297198 0.817786 0.564110
C 2.047159 0.112052 -0.038621
C 13.655823 0.300005 0.044349
C -0.349170 -0.341439 -0.410526
C -1.328028 -1.108602 -1.102043
C -0.749938 0.646781 0.525554
C -3.114337 0.098385 0.078567
C -2.689274 -0.890009 -0.859984
C -2.124869 0.855185 0.759348
C -4.536636 0.340928 0.347682
C -6.860453 -0.051403 -0.017183
C -9.672834 0.400274 0.343274
C -7.366179 1.264430 0.195322
C -7.786035 -1.128841 -0.081133
C -8.749209 1.477708 0.367261
C -9.163002 -0.905219 0.109768
C -11.157546 0.632694 0.562403
H 7.090510 1.562714 0.078177
H 7.102266 0.320563 1.347950
H 8.581721 -1.143939 -0.101023
H 8.573634 0.101852 -1.366745
H 6.010507 -1.320739 -0.246033
H 5.998373 -0.079933 -1.516699
H 9.669757 0.490790 1.502205
H 9.661440 1.737694 0.237377
H 4.521939 1.386169 -0.075883
H 4.539905 0.150572 1.202188
H 11.149349 0.281020 -1.209575
H 11.155943 -0.967709 0.053291
H 3.419551 -0.273510 -1.660648
H 3.435580 -1.505289 -0.378006
H 12.236493 0.664506 1.661151
H 12.229641 1.912806 0.399666
H 1.959694 -0.044199 1.057018
H 1.932738 1.195033 -0.254068
H 14.502109 0.807626 0.542926
H 13.760181 -0.786869 0.223876
H 13.753822 0.469749 -1.044692
H -0.986781 -1.863108 -1.817473
H -0.012192 1.246291 1.066184
H -3.457895 -1.469684 -1.380683
H -2.435779 1.618576 1.484082
H -4.756051 1.133161 1.096913
H -6.680964 2.120534 0.182235
H -7.395968 -2.132631 -0.278226
H -9.122092 2.499611 0.511270
H -9.857699 -1.753141 0.066076
H -11.769532 -0.084442 -0.013265
H -11.457682 1.652980 0.264943
H -11.427577 0.509320 1.629858


