%chk=000142978.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000142978

0 1
 O   -5.430600      -1.922500      -1.040300    
 O    5.432900      -1.925000       1.034900    
 N   -5.628200      0.3300000     -0.4448000    
 N    5.630500      0.3287000      0.4443000    
 C   -6.967200       2.354000       1.118700    
 C    6.967800       2.355700      -1.116900    
 C   -7.686700       1.079000      0.6777000    
 C   -5.459200       2.126500       1.225800    
 C    7.687500       1.079400     -0.6801000    
 C    5.459600       2.129100      -1.222100    
 C   -7.076400      0.5187000     -0.6041000    
 C   -4.893500       1.536500     -6.3699998E-02
 C    7.078900      0.5164000      0.6016000    
 C    4.895700       1.536400      6.7000002E-02
 C   -4.932500     -0.8595000     -0.6729000    
 C    4.934700     -0.8610000      0.6707000    
 C   -3.477900     -0.8600000     -0.4736000    
 C    3.479700     -0.8604000      0.4738000    
 C  -0.7184000     -0.8604000     -9.6699998E-02
 C   0.7153000     -0.8599000      9.8499998E-02
 C   -2.949300      -1.174400      0.7758000    
 C    2.631500     -0.5485000       1.536400    
 C   -2.633700     -0.5459000      -1.535600    
 C    2.945600      -1.171900     -0.7766000    
 C   -1.567200      -1.174500      0.9645000    
 C    1.249300     -0.5485000       1.348800    
 C   -1.251600     -0.5461000      -1.346800    
 C    1.563400      -1.171700     -0.9642000    
 H   -7.165100       3.153600      0.3944000    
 H   -7.362300       2.689100       2.084200    
 H    7.167300       3.153600     -0.3911000    
 H    7.361400       2.692800      -2.082200    
 H   -7.609500      0.3299000       1.475700    
 H   -8.751900       1.284000      0.5259000    
 H   -4.957500       3.073100       1.454900    
 H   -5.257300       1.441300       2.058600    
 H    7.608700      0.3322000      -1.479700    
 H    8.753100       1.283700     -0.5294000    
 H    4.957800       3.076500      -1.448100    
 H    5.256000       1.446000      -2.056200    
 H   -7.540600     -0.4392000     -0.8597000    
 H   -7.231800       1.204300      -1.444800    
 H   -5.015000       2.253800     -0.8852000    
 H   -3.820400       1.398800      6.5300003E-02
 H    7.543200     -0.4422000      0.8542000    
 H    7.236100       1.200100       1.443500    
 H    5.018800       2.251800      0.8900000    
 H    3.822300       1.399400     -6.0500000E-02
 H   -3.602800      -1.425900       1.607100    
 H    3.038100     -0.2975000       2.512700    
 H   -3.040100     -0.2928000      -2.511300    
 H    3.598000      -1.421900      -1.609400    
 H   -1.197200      -1.454800       1.947000    
 H   0.6300000     -0.2697000       2.196800    
 H  -0.6320000     -0.2648000      -2.193900    
 H    1.192900      -1.450300      -1.946800    


%chk=000142978-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000142978

0 1
O -5.600401 -1.840286 1.052004
O 5.600981 -1.840278 -1.051170
N -5.905760 0.145840 -0.134544
N 5.906285 0.145714 0.135726
C -7.696570 2.420627 0.355100
C 7.695330 2.421269 -0.356931
C -8.093225 0.979594 0.754346
C -6.158948 2.579549 0.376732
C 8.092227 0.980231 -0.755951
C 6.157592 2.579451 -0.376608
C -7.375829 -0.053834 -0.142796
C -5.468296 1.511013 -0.508963
C 7.376489 -0.053184 0.142564
C 5.468654 1.510806 0.510285
C -5.099995 -0.838524 0.438839
C 5.100562 -0.838673 -0.437741
C -3.601471 -0.730579 0.288453
C 3.602066 -0.731013 -0.286960
C -0.742353 -0.762626 0.058901
C 0.742977 -0.762794 -0.057123
C -2.789425 -1.096593 1.391854
C 2.969956 -0.413804 0.943074
C -2.969194 -0.412903 -0.941368
C 2.789885 -1.096639 -1.390377
C -1.386774 -1.099806 1.282988
C 1.565890 -0.433847 1.055448
C -1.565121 -0.433070 -1.053602
C 1.387242 -1.099710 -1.281367
H -8.074540 2.636151 -0.666278
H -8.168912 3.155932 1.033261
H 8.074517 2.637523 0.663842
H 8.166447 3.156446 -1.036083
H -7.818775 0.790775 1.810118
H -9.187398 0.837801 0.667438
H -5.862774 3.584538 0.018645
H -5.789637 2.476497 1.416088
H 7.816517 0.790719 -1.811271
H 9.186587 0.839074 -0.670394
H 5.861420 3.584384 -0.018370
H 5.786945 2.475993 -1.415444
H -7.569276 -1.082364 0.200657
H -7.731706 0.050099 -1.189372
H -5.727306 1.694665 -1.573489
H -4.375648 1.588029 -0.406969
H 7.570189 -1.081750 -0.200623
H 7.733436 0.051463 1.188686
H 5.729044 1.694837 1.574397
H 4.375830 1.587283 0.409807
H -3.278098 -1.403809 2.322067
H 3.578011 -0.172447 1.822283
H -3.577111 -0.171147 -1.820566
H 3.278423 -1.403592 -2.320745
H -0.784233 -1.407508 2.144588
H 1.102659 -0.167250 2.011795
H -1.101758 -0.166109 -2.009782
H 0.784571 -1.407063 -2.143000


