%chk=000114785.chk
%nprocshared=8
%mem=28GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000114785

0 1
 N   -4.000900      2.2000000E-03 -4.5200001E-02
 N    1.581200     -2.0199999E-02  0.6271000    
 N    2.147600      1.4100000E-02 -0.4906000    
 C   -6.247400     -0.6928000     -2.7899999E-02
 C   -6.174200      0.7158000     -0.5910000    
 C   -4.816100      -1.202400     -0.1805000    
 C   -4.815100       1.213700     -0.1044000    
 C   -2.632500     -3.5000001E-03  0.1194000    
 C   -1.884800      -1.214100      0.1722000    
 C   -1.884000       1.200800      0.2467000    
 C  -0.5000000      -1.219800      0.3390000    
 C  -0.4990000       1.195000      0.4135000    
 C   0.1928000     -1.5300000E-02  0.4596000    
 C    3.543000      9.4999997E-03 -0.3228000    
 C    4.228600      -1.200400     -0.2773000    
 C    4.228400       1.214500     -0.2029000    
 C    5.613500      -1.205500     -0.1099000    
 C    5.613200       1.209300     -3.5700001E-02
 C    6.305700     -7.9999998E-04  1.0800000E-02
 H   -6.522300     -0.6561000       1.033200    
 H   -6.973800      -1.323300     -0.5482000    
 H   -6.191200      0.6802000      -1.687000    
 H   -6.997600       1.352600     -0.2561000    
 H   -4.604600      -1.948400      0.5927000    
 H   -4.666300      -1.649600      -1.169700    
 H   -4.421100       1.957300     -0.8051000    
 H   -4.899200       1.660300      0.8928000    
 H   -2.382200      -2.176500      7.5999998E-02
 H   -2.382000       2.167400      0.2232000    
 H   3.0900000E-02  -2.167700      0.3731000    
 H   3.2299999E-02   2.138500      0.5088000    
 H    3.697200      -2.143700     -0.3712000    
 H    3.696800       2.161600     -0.2386000    
 H    6.152700      -2.147600     -7.3799998E-02
 H    6.152400       2.147400      5.8200002E-02
 H    7.383900     -4.6999999E-03  0.1410000    


%chk=000114785-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000114785

0 1
N -4.093241 0.024056 -0.065039
N 1.538941 0.281587 0.492383
N 2.293173 -0.256915 -0.443090
C -6.278747 -0.712078 -0.662342
C -6.397609 0.576456 0.190978
C -4.810614 -0.687090 -1.149128
C -5.020855 0.673930 0.889839
C -2.714113 0.075188 0.048037
C -1.867849 -0.495714 -0.965780
C -2.086104 0.698636 1.176791
C -0.476154 -0.447637 -0.853321
C -0.689871 0.742960 1.278028
C 0.143369 0.174202 0.274127
C 3.700762 -0.136396 -0.203261
C 4.288488 0.509998 0.923126
C 4.537222 -0.721599 -1.191620
C 5.689733 0.562122 1.045481
C 5.940742 -0.665042 -1.061432
C 6.522860 -0.023323 0.057412
H -6.451307 -1.603208 -0.031583
H -6.995113 -0.741222 -1.500151
H -6.550790 1.453569 -0.463971
H -7.229787 0.538965 0.913467
H -4.402839 -1.705602 -1.291583
H -4.711883 -0.144080 -2.113050
H -4.723366 1.723038 1.078260
H -5.020864 0.142053 1.865119
H -2.317965 -0.964237 -1.846792
H -2.696127 1.133653 1.973737
H 0.167897 -0.879300 -1.626052
H -0.204744 1.214661 2.139460
H 3.628202 0.955340 1.673608
H 4.059816 -1.211441 -2.047140
H 6.142504 1.058985 1.911613
H 6.579193 -1.118668 -1.827808
H 7.612939 0.021951 0.161077


