%chk=000037909.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000037909

1 1
 O   4.7699999E-02  -2.032600      0.7934000    
 N    4.285500     -0.6446000     -0.3890000    
 C    3.621000      0.6514000     -0.6602000    
 C    3.314400       1.381100      0.6417000    
 C    2.576300       2.717500      0.4994000    
 C    1.229600       2.660600     -0.2281000    
 C   0.2352000       1.685400      0.4074000    
 C   -1.119400       1.737100     -0.3043000    
 C   -2.164600      0.7997000      0.3073000    
 C    5.584800     -0.4584000      0.3971000    
 C    4.579300      -1.411100      -1.679900    
 C   -3.511000      0.8331000     -0.4193000    
 C    3.425900      -1.493800      0.4146000    
 C   -4.537800     -6.4000003E-02  0.2756000    
 C   -5.895500     -2.4999999E-03 -0.4263000    
 C    2.240300      -1.859600     -8.8799998E-02
 C   -6.912000     -0.9240000      0.2474000    
 C    1.272600      -2.735200      0.6387000    
 C   -8.272100     -0.8402000     -0.4269000    
 H    2.721600      0.4882000      -1.263400    
 H    4.307300       1.252300      -1.270600    
 H    4.247500       1.624900       1.162700    
 H    2.737500      0.7585000       1.334100    
 H    3.225200       3.423900     -3.3199999E-02
 H    2.421000       3.137400       1.501200    
 H   0.7985000       3.669600     -0.2274000    
 H    1.387000       2.394500      -1.279800    
 H   0.6217000      0.6639000      0.3569000    
 H   0.1023000       1.933000       1.467200    
 H   -1.504100       2.764200     -0.2780000    
 H  -0.9810000       1.477900      -1.361300    
 H   -2.311800       1.071100       1.360100    
 H   -1.781200     -0.2260000      0.2946000    
 H    6.196800      0.2821000     -0.1273000    
 H    5.373300     -0.1339000       1.420400    
 H    6.113500      -1.418100      0.4250000    
 H    5.367400     -0.8658000      -2.210200    
 H    4.933500      -2.418100      -1.432800    
 H    3.689600      -1.445000      -2.315800    
 H   -3.376000      0.5091000      -1.458200    
 H   -3.884300       1.864100     -0.4472000    
 H    3.742200      -1.829100       1.397900    
 H   -4.652500      0.2473000       1.321100    
 H   -4.173200      -1.098400      0.2843000    
 H   -6.267800       1.029100     -0.4135000    
 H   -5.780200     -0.2913000      -1.478100    
 H    1.903600      -1.538500      -1.070100    
 H   -7.018600     -0.6521000       1.304000    
 H   -6.555500      -1.960000      0.2132000    
 H    1.084400      -3.643200      5.7300001E-02
 H    1.637800      -3.020800       1.630200    
 H   -8.671700      0.1779000     -0.3793000    
 H   -8.983200      -1.507600      6.9899999E-02
 H   -8.207100      -1.135400      -1.479000    
 H  -0.5692000      -2.629900       1.249700    


%chk=000037909-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000037909

1 1
O -0.090764 -2.392938 0.329876
N 4.198861 -0.709110 -0.376537
C 3.653312 0.751768 -0.567883
C 3.383115 1.520559 0.730470
C 2.706423 2.890357 0.426189
C 1.330938 2.802921 -0.285038
C 0.290362 1.907738 0.427835
C -1.096814 1.936367 -0.254085
C -2.104234 0.953951 0.384905
C 5.532923 -0.693313 0.372394
C 4.434984 -1.303710 -1.764415
C -3.485642 0.962813 -0.307572
C 3.203057 -1.503191 0.430391
C -4.484221 -0.043368 0.307746
C -5.865989 -0.036713 -0.384410
C 2.224998 -2.266659 -0.096608
C -6.860251 -1.052817 0.222807
C 1.194825 -2.964483 0.758117
C -8.236959 -1.038734 -0.475704
H 2.722343 0.625944 -1.144423
H 4.401482 1.271690 -1.194451
H 4.323975 1.710724 1.279668
H 2.713032 0.939271 1.388806
H 3.396492 3.519328 -0.171573
H 2.577539 3.408129 1.395722
H 0.926274 3.830932 -0.361411
H 1.452435 2.461093 -1.334824
H 0.636044 0.852070 0.458493
H 0.187964 2.232954 1.484172
H -1.505128 2.967119 -0.215771
H -0.981511 1.688400 -1.330534
H -2.232871 1.204561 1.458777
H -1.679212 -0.071490 0.350226
H 6.238405 -0.042542 -0.166724
H 5.378303 -0.309487 1.390356
H 5.922357 -1.721729 0.418827
H 5.241802 -0.736185 -2.252475
H 4.722831 -2.360472 -1.661963
H 3.518528 -1.215761 -2.365009
H -3.357185 0.735922 -1.386867
H -3.917586 1.983733 -0.255278
H 3.325532 -1.353623 1.506317
H -4.615032 0.181247 1.387071
H -4.054486 -1.066777 0.252813
H -6.302394 0.981897 -0.322332
H -5.737563 -0.252993 -1.465822
H 2.078655 -2.390218 -1.176407
H -6.990108 -0.835039 1.302653
H -6.424170 -2.071445 0.161178
H 1.235435 -4.056771 0.563406
H 1.378008 -2.789397 1.837179
H -8.709806 -0.041535 -0.400377
H -8.928114 -1.773735 -0.024533
H -8.139643 -1.282186 -1.550577
H -0.837048 -2.989369 0.591610


