%chk=000097622.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097622

0 1
 O   0.8301000      -2.961800      5.0000002E-04
 O    3.224700      -2.964100      8.9999998E-04
 O   -1.193800       3.213300     -2.0999999E-03
 O   -5.085100      4.1099999E-02  1.2000001E-03
 N    1.449800       3.140200      6.9999998E-04
 C   0.5861000     -0.5016000     -7.9999998E-04
 C    1.359500      0.6950000     -3.9999999E-04
 C  -0.8996000     -0.3988000     -6.0000003E-04
 C    1.321700      -1.688100     -5.0000002E-04
 C    2.783600      0.6701000     -9.9999997E-05
 C   0.7779000       1.964200     -1.9999999E-04
 C   -1.516800      0.8723000      3.0000001E-04
 C    2.703700      -1.705000     -3.0000001E-04
 C  -0.6867000       2.098600     -3.9999999E-04
 C    3.457300     -0.5531000     -1.9999999E-04
 C   -1.766400      -1.507800     -1.3000000E-03
 C    3.499900       1.871800      6.0000003E-04
 C   -2.913000       1.022900      1.3000000E-03
 C    2.027700      -3.755500      9.9999997E-05
 C   -3.732700     -9.8200001E-02  7.9999998E-04
 C   -3.159800      -1.361900     -7.9999998E-04
 C    2.794500       3.062400      1.0000000E-03
 C   -5.862700      -1.155900      9.9999997E-05
 H    4.541900     -0.6063000      3.0000001E-04
 H   -1.397700      -2.527000     -2.4000001E-03
 H    4.585800       1.887500      8.9999998E-04
 H   -3.370500       2.009200      2.2000000E-03
 H    2.026600      -4.394100     -0.8907000    
 H    2.026400      -4.395400      0.8900000    
 H   -3.733200      -2.283100     -1.5000000E-03
 H    3.313500       4.015200      1.6000000E-03
 H   -5.696100      -1.744300      0.9088000    
 H   -5.696500      -1.742300     -0.9099000    
 H   -6.916000     -0.8572000      6.0000003E-04


%chk=000097622-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097622

0 1
O 0.833442 -2.991778 -0.000005
O 3.221170 -3.033075 0.000337
O -1.315969 3.287540 -0.000642
O -5.110498 0.047000 -0.000139
N 1.463713 3.205396 0.000441
C 0.589118 -0.478596 0.000042
C 1.386889 0.737664 0.000225
C -0.878393 -0.401240 -0.000020
C 1.330475 -1.665206 -0.000007
C 2.838486 0.693496 0.000469
C 0.765413 2.037780 0.000154
C -1.518597 0.882187 -0.000182
C 2.758464 -1.700206 0.000182
C -0.736360 2.160481 -0.000335
C 3.538353 -0.563430 0.000451
C -1.711141 -1.554819 0.000103
C 3.544634 1.931818 0.000734
C -2.924660 0.985576 -0.000232
C 2.016255 -3.892048 -0.001168
C -3.729285 -0.172377 -0.000101
C -3.114430 -1.452989 0.000070
C 2.830827 3.138840 0.000754
C -5.988747 -1.126989 0.000003
H 4.629721 -0.607456 0.000656
H -1.256958 -2.546956 0.000244
H 4.639697 1.936528 0.000930
H -3.382678 1.978816 -0.000382
H 2.002213 -4.498134 -0.922579
H 2.001916 -4.500879 0.918383
H -3.714895 -2.367443 0.000182
H 3.352452 4.101968 0.001021
H -5.833439 -1.744971 0.905532
H -5.833438 -1.745192 -0.905374
H -7.009651 -0.719004 -0.000048


