%chk=000173279.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000173279

1 1
 N    3.634600      0.8797000     -0.5687000    
 N   -5.100000      0.6534000      0.1587000    
 N   -7.625800      -3.453500     -0.3967000    
 C    3.466500      -1.373100      8.8600002E-02
 C    4.889400     -0.9010000      0.1494000    
 C    2.774000     -8.1100002E-02 -0.4010000    
 C    4.932700      0.4318000     -0.2478000    
 C    3.297800      -2.505900     -0.9267000    
 C    2.954600      -1.780500       1.472400    
 C    6.045000      -1.569700      0.5179000    
 C    1.327200     -1.1900000E-02 -0.6275000    
 C    6.120900       1.143100     -0.2920000    
 C    3.433900       2.266500      -1.018200    
 C    7.253500     -0.8705000      0.4802000    
 C    7.290800      0.4751000      7.8500003E-02
 C   0.5433000      0.3449000      0.3955000    
 C  -0.9251000      0.4499000      0.3285000    
 C   -1.535100       1.648900     -6.6000000E-03
 C   -3.692700      0.5850000      0.2163000    
 C   -1.674100     -0.6833000      0.6087000    
 C   -2.927100       1.717100     -6.2899999E-02
 C   -3.066100     -0.6151000      0.5521000    
 C   -5.904000     -0.5211000      0.4331000    
 C   -5.761100       1.895600     -0.1892000    
 C  -0.7467000       2.881600     -0.3126000    
 C   -6.158800      -1.315900     -0.8432000    
 C   -5.868900       2.820400       1.005700    
 C   -6.978800      -2.510500     -0.5924000    
 H    3.624500      -2.200600      -1.928100    
 H    3.881200      -3.389200     -0.6429000    
 H    2.248600      -2.811500      -1.007900    
 H    3.012900     -0.9497000       2.185700    
 H    1.909300      -2.106100       1.432200    
 H    3.540000      -2.609800       1.885900    
 H    6.020300      -2.608500      0.8287000    
 H   0.9455000     -0.2566000      -1.611300    
 H    6.168100       2.182100     -0.5987000    
 H    4.025300       2.435800      -1.922600    
 H    3.737800       2.945600     -0.2166000    
 H    2.378000       2.428800      -1.247500    
 H    8.175200      -1.371100      0.7644000    
 H    8.241600       1.001200      5.6299999E-02
 H   0.9692000      0.5866000       1.366600    
 H   -1.198300      -1.625600      0.8682000    
 H   -3.369600       2.670300     -0.3306000    
 H   -3.598700      -1.535600      0.7615000    
 H   -6.877600     -0.1939000      0.8267000    
 H   -5.511500      -1.142900       1.245800    
 H   -5.297500       2.393900      -1.048200    
 H   -6.782300       1.679800     -0.5311000    
 H  -0.2070000       2.762900      -1.257500    
 H   -1.388500       3.764300     -0.4096000    
 H  -3.3199999E-02   3.098400      0.4895000    
 H   -6.660700     -0.6824000      -1.584600    
 H   -5.209100      -1.624300      -1.295800    
 H   -6.420300       2.340300       1.821600    
 H   -4.892800       3.115500       1.400600    
 H   -6.407200       3.732700      0.7292000    


%chk=000173279-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000173279

1 1
N 3.715849 0.809264 0.072291
N -5.180840 0.721587 0.078645
N -7.355347 -3.687287 0.374606
C 3.604890 -1.566477 0.131703
C 5.050452 -1.085119 0.051621
C 2.823150 -0.233569 0.110931
C 5.071129 0.328339 0.009775
C 3.227488 -2.448725 -1.096451
C 3.336866 -2.341308 1.459085
C 6.255876 -1.801601 0.017052
C 1.406195 -0.197976 0.141625
C 6.263264 1.069460 -0.077903
C 3.399915 2.242387 0.163629
C 7.473827 -1.078956 -0.065029
C 7.474234 0.336649 -0.113794
C 0.530588 0.872441 -0.102882
C -0.904170 0.831456 -0.049858
C -1.688811 1.995402 -0.417901
C -3.798159 0.756072 0.046205
C -1.622314 -0.340818 0.369722
C -3.085773 1.937560 -0.361708
C -3.009208 -0.392541 0.420055
C -5.915678 -0.464671 0.562996
C -6.014359 1.878334 -0.350955
C -1.028882 3.289454 -0.863733
C -6.117448 -1.524784 -0.567328
C -6.242313 2.912327 0.773008
C -6.803763 -2.724016 -0.061925
H 3.411791 -1.918234 -2.046260
H 3.837787 -3.368534 -1.092336
H 2.164396 -2.744911 -1.060697
H 3.578992 -1.726531 2.342798
H 2.281859 -2.660436 1.528817
H 3.965860 -3.247854 1.488128
H 6.266374 -2.896161 0.050877
H 0.962339 -1.180341 0.336321
H 6.280364 2.162068 -0.129111
H 4.288824 2.786508 0.514930
H 2.589442 2.400549 0.894185
H 3.099893 2.653744 -0.816972
H 8.424966 -1.619423 -0.095202
H 8.424429 0.875234 -0.184243
H 0.959801 1.831453 -0.406527
H -1.067995 -1.235465 0.670803
H -3.643942 2.837306 -0.631403
H -3.488223 -1.318026 0.748428
H -6.902323 -0.136182 0.930512
H -5.396338 -0.921455 1.421979
H -5.554072 2.352059 -1.235638
H -6.986378 1.475279 -0.687426
H -0.413477 3.145170 -1.771388
H -1.784804 4.054970 -1.100750
H -0.373821 3.709799 -0.077380
H -6.709237 -1.087961 -1.393290
H -5.139570 -1.818978 -0.991283
H -6.750611 2.454130 1.639648
H -5.290418 3.344741 1.126170
H -6.879466 3.734900 0.402825


