%chk=000089953.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089953

0 1
 O    2.329000       1.224600      7.1000000E-03
 N   0.9690000     -0.6964000      5.9000002E-03
 N   -3.826500      -1.396500     -3.8999999E-03
 C  -0.3268000     -0.1791000      3.4000000E-03
 C    3.370700     -0.9465000      9.9999998E-03
 C   -1.422700      -1.042000      1.2000001E-03
 C    2.184700      6.5000001E-03  7.3000002E-03
 C  -0.5261000       1.201400      1.6000000E-03
 C   -2.717900     -0.5243000     -2.7999999E-03
 C   -1.821300       1.719100     -2.2000000E-03
 C   -2.917200      0.8563000     -4.4999998E-03
 C    4.705000     -0.2231000     -2.3000000E-02
 H    3.312100      -1.568500      0.9103000    
 H    3.289400      -1.604300     -0.8629000    
 H    1.030100      -1.712500      6.8999999E-03
 H   -1.269000      -2.119200      2.4000001E-03
 H   0.2699000       1.932600      3.1000001E-03
 H   -1.977700       2.794000     -3.4000000E-03
 H   -3.921500       1.272100     -7.3000002E-03
 H    4.793500      0.3978000     -0.9207000    
 H    5.529100     -0.9431000     -2.2600001E-02
 H    4.820500      0.4292000      0.8489000    
 H   -4.765700      -1.021300     -8.7000001E-03
 H   -3.683200      -2.397600     -4.4999998E-03


%chk=000089953-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000089953

0 1
O 2.356060 1.267958 0.417434
N 1.002554 -0.632349 0.122757
N -3.781397 -1.439739 -0.296398
C -0.313055 -0.078026 0.086837
C 3.437951 -0.934301 0.339466
C -1.383901 -0.993482 -0.081402
C 2.228328 0.014246 0.290060
C -0.565836 1.313480 0.209523
C -2.727358 -0.536651 -0.130047
C -1.907225 1.752946 0.159995
C -2.983103 0.860601 -0.006309
C 4.653650 -0.346617 -0.408806
H 3.700887 -1.073470 1.407406
H 3.181167 -1.935367 -0.059655
H 1.049755 -1.648533 0.018206
H -1.176225 -2.068824 -0.174791
H 0.265304 2.006902 0.336884
H -2.114619 2.825194 0.253754
H -4.014240 1.231943 -0.041818
H 4.466788 -0.294202 -1.496154
H 5.554417 -0.962748 -0.239591
H 4.849467 0.677779 -0.050400
H -4.741222 -1.110908 -0.331296
H -3.610745 -2.436631 -0.384056


