%chk=000059200.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059200

0 1
 O    4.706000       1.475300      -1.145000    
 N  -0.5560000      0.4547000      0.3214000    
 C    1.865900      7.8299999E-02  0.3551000    
 C    3.182700      0.4473000       1.042900    
 C   0.6860000      0.8021000       1.001900    
 C    4.352100     -0.2880000      0.4396000    
 C    5.052400      0.2653000     -0.6231000    
 C   -1.684800       1.163800      0.9071000    
 C    4.709500      -1.521200      0.9669000    
 C    6.132200     -0.4286000      -1.169600    
 C    5.789200      -2.215000      0.4203000    
 C   -2.969600      0.8228000      0.2120000    
 C    6.500400      -1.668700     -0.6479000    
 C   -4.021200      0.2710000      0.8380000    
 C   -5.306900     -6.5700002E-02  0.2039000    
 C    5.325100       2.627400     -0.5764000    
 C   -5.368100     -0.2097000      -1.173300    
 C   -6.432200     -0.2323000      0.9957000    
 C   -6.586000     -0.5284000      -1.774100    
 C   -7.650000     -0.5512000      0.3948000    
 C   -7.726800     -0.6992000     -0.9902000    
 H    1.709300      -1.007200      0.4096000    
 H    1.919800      0.3358000     -0.7109000    
 H    3.120200      0.2053000       2.112500    
 H    3.334700       1.531200       1.007100    
 H   0.6274000      0.5288000       2.062500    
 H   0.8549000       1.884200      0.9421000    
 H  -0.7073000     -0.5514000      0.3968000    
 H   -1.534700       2.246400      0.8140000    
 H   -1.758200      0.9367000       1.978100    
 H    4.161600      -1.957600       1.797300    
 H    6.690500     -9.4999997E-03  -2.002300    
 H    6.075600      -3.180800      0.8259000    
 H   -3.010000       1.086700     -0.8409000    
 H    7.340800      -2.209000      -1.073700    
 H   -3.949100      5.3399999E-02   1.901400    
 H    6.342400       2.728000     -0.9673000    
 H    5.355400       2.577500      0.5167000    
 H    4.748200       3.507900     -0.8719000    
 H   -4.502400     -0.1081000      -1.820100    
 H   -6.388900     -0.1190000       2.075700    
 H   -6.645500     -0.6489000      -2.851900    
 H   -8.538500     -0.6842000       1.005100    
 H   -8.674700     -0.9486000      -1.457800    


%chk=000059200-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000059200

0 1
O 4.478167 1.587157 -0.686666
N -0.542551 0.461967 0.720763
C 1.922003 0.106559 0.734491
C 3.248703 0.345985 1.506687
C 0.712731 0.732507 1.454321
C 4.449986 -0.275782 0.816701
C 5.056634 0.358936 -0.308480
C -1.762815 1.020419 1.347144
C 4.992319 -1.508004 1.245578
C 6.161868 -0.225079 -0.972202
C 6.094912 -2.108608 0.591724
C -2.968498 0.808144 0.461429
C 6.676675 -1.462002 -0.518318
C -4.126499 0.219967 0.877160
C -5.351584 -0.009988 0.083096
C 5.082710 2.307875 -1.807600
C -5.488779 0.394347 -1.276793
C -6.455053 -0.666760 0.698345
C -6.679807 0.146687 -1.987590
C -7.649030 -0.914977 -0.011971
C -7.767875 -0.509266 -1.360815
H 1.762636 -0.985666 0.618196
H 2.001197 0.534494 -0.280603
H 3.155224 -0.074108 2.527507
H 3.398748 1.437780 1.607472
H 0.682698 0.361678 2.512747
H 0.847479 1.831972 1.509627
H -0.654594 -0.540284 0.513136
H -1.588155 2.110247 1.475539
H -1.968238 0.611575 2.369180
H 4.539819 -2.003073 2.113815
H 6.624661 0.267093 -1.832922
H 6.493815 -3.064157 0.948174
H -2.846741 1.158668 -0.572711
H 7.531747 -1.911704 -1.035563
H -4.174513 -0.128240 1.921050
H 5.022611 1.721334 -2.745195
H 6.139950 2.564681 -1.599575
H 4.490288 3.229222 -1.909711
H -4.660644 0.906357 -1.779240
H -6.369123 -0.984584 1.745289
H -6.765003 0.465791 -3.032757
H -8.483873 -1.422737 0.484249
H -8.692810 -0.698823 -1.916708


