%chk=000059642.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059642

2 1
 N   -2.986300      0.1511000      0.4495000    
 N  -0.2543000      0.8647000     -0.4386000    
 N    3.826600     -0.3595000      0.1070000    
 C   -1.733300     -0.3562000       1.195000    
 C   -2.618400      0.2428000      -1.046900    
 C   -1.379300      -1.780100      0.7207000    
 C   -2.293300      -1.161100      -1.595900    
 C  -0.5637000      0.6303000      0.9751000    
 C   -1.435100       1.220300      -1.231400    
 C   -1.246900      -1.937200     -0.7948000    
 C   -4.200800     -0.7710000      0.6826000    
 C   -3.454100       1.515900      0.9990000    
 C   0.8074000       1.855100     -0.5932000    
 C    2.090900       1.366900      7.5700000E-02
 C    2.557400      5.4499999E-02 -0.5380000    
 C    3.641200     -0.5247000       1.622200    
 C    4.316600      -1.699100     -0.4614000    
 C    4.925400      0.6872000     -0.1266000    
 H   -1.990200     -0.3824000       2.261400    
 H   -3.500300      0.6397000      -1.565000    
 H   -2.132200      -2.487200       1.088000    
 H  -0.4415000      -2.100800       1.192200    
 H   -1.952100      -1.077100      -2.635600    
 H   -3.212700      -1.755400      -1.651300    
 H  -0.7643000       1.574500       1.495100    
 H   0.2926000      0.1808000       1.489000    
 H   -1.160400       1.218800      -2.294400    
 H   -1.756800       2.245400      -1.012500    
 H  -0.2461000      -1.623900      -1.110000    
 H   -1.305200      -3.001000      -1.055900    
 H   -3.995000      -1.781300      0.3308000    
 H   -4.410000     -0.7930000       1.756500    
 H   -5.051800     -0.3581000      0.1321000    
 H   -3.699400       1.390200       2.058100    
 H   -2.671800       2.266300      0.8930000    
 H   -4.338000       1.825600      0.4330000    
 H   0.5135000       2.823600     -0.1685000    
 H    1.011700       2.021300      -1.658700    
 H    1.959000       1.334100       1.158700    
 H    2.824300       2.159800     -0.1076000    
 H    2.737000      0.1577000      -1.615000    
 H    1.835800     -0.7535000     -0.3823000    
 H    4.527400      -1.031300       2.018200    
 H    2.750900      -1.135400       1.798100    
 H    3.559100      0.4539000       2.100800    
 H    5.254800      -1.970200      3.1500001E-02
 H    3.547900      -2.452500     -0.2659000    
 H    4.469600      -1.575100      -1.537500    
 H    5.878100      0.2559000      0.1974000    
 H    4.725800       1.580600      0.4696000    
 H    4.961900      0.9180000      -1.195100    


%chk=000059642-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000059642

2 1
N -3.213396 0.215277 0.329890
N -0.314486 0.776877 -0.171222
N 4.169881 -0.325335 -0.020453
C -2.089763 -0.269982 1.307817
C -2.589740 0.134605 -1.106673
C -1.758788 -1.758051 1.030698
C -2.278753 -1.339199 -1.465075
C -0.870608 0.679624 1.205331
C -1.365989 1.078639 -1.185275
C -1.361222 -2.054066 -0.439481
C -4.468754 -0.654461 0.446876
C -3.675415 1.636562 0.663091
C 0.801155 1.762317 -0.264501
C 2.141781 1.289727 0.357877
C 2.739370 0.116064 -0.438421
C 4.204776 -0.762818 1.443173
C 4.570901 -1.513284 -0.902527
C 5.180241 0.804286 -0.237587
H -2.516212 -0.168699 2.323720
H -3.365919 0.526402 -1.790659
H -2.607112 -2.391903 1.344954
H -0.929586 -2.034466 1.707825
H -1.794856 -1.333703 -2.458763
H -3.221810 -1.895947 -1.608271
H -1.125299 1.684291 1.622594
H -0.102258 0.261663 1.880956
H -0.930937 0.944547 -2.192428
H -1.701149 2.141963 -1.136760
H -0.323717 -1.721118 -0.603705
H -1.396602 -3.143844 -0.615048
H -4.249659 -1.701606 0.219447
H -4.853967 -0.574904 1.475565
H -5.222421 -0.275717 -0.261083
H -4.097596 1.638477 1.680124
H -2.846774 2.350331 0.613212
H -4.452809 1.930285 -0.059308
H 0.523173 2.729202 0.219813
H 0.963210 1.984567 -1.336189
H 1.991069 1.020117 1.418698
H 2.817064 2.164811 0.337390
H 2.814560 0.379869 -1.508957
H 2.098951 -0.778490 -0.348433
H 5.211539 -1.141455 1.677102
H 3.464301 -1.562406 1.598571
H 3.980644 0.096418 2.090747
H 5.581990 -1.845768 -0.622681
H 3.854671 -2.335056 -0.750301
H 4.563652 -1.198476 -1.957189
H 6.190804 0.417856 -0.034735
H 4.965413 1.634697 0.449468
H 5.118051 1.149179 -1.281014


