%chk=000013976.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000013976

0 1
 O    2.588800       2.589600     -1.5000000E-03
 O   -2.588600      -2.589400     -1.5000000E-03
 N    2.405000      -1.455100     -1.2000001E-03
 N   -2.405100       1.455400     -1.6000000E-03
 C    1.220600      0.6669000     -1.7000000E-03
 C   -1.220500     -0.6666000     -1.9000000E-03
 C    1.201100     -0.7376000     -2.0000001E-03
 C   -1.201000      0.7379000     -2.0000001E-03
 C   2.9999999E-02   1.402300     -2.2000000E-03
 C  -2.9899999E-02  -1.401900     -2.0999999E-03
 C    3.775100      0.5515000      3.9999999E-04
 C   -3.775100     -0.5515000      9.9999997E-05
 C    3.667700     -0.8490000     -9.9999997E-05
 C   -3.667800      0.8490000     -1.9999999E-04
 C    2.532500       1.366800     -5.0000002E-04
 C   -2.532300      -1.366600     -1.0000000E-03
 C    5.027500       1.172300      1.9000000E-03
 C   -5.027500      -1.172500      1.9000000E-03
 C    4.836100      -1.618600      1.3000000E-03
 C   -4.836300       1.618400      1.2000001E-03
 C    6.182600      0.3910000      3.1000001E-03
 C   -6.182600     -0.3916000      3.5999999E-03
 C    6.087700      -1.000400      2.9000000E-03
 C   -6.087800      0.9998000      3.1000001E-03
 H   5.0900001E-02   2.489600     -2.0999999E-03
 H  -5.0799999E-02  -2.489100     -2.0000001E-03
 H    2.359600      -2.465800     -2.4999999E-03
 H   -2.359800       2.466000     -1.4000000E-03
 H    5.122700       2.254300      2.2000000E-03
 H   -5.122300      -2.254600      2.4000001E-03
 H    4.780400      -2.704400      1.1000000E-03
 H   -4.781000       2.704200      1.0000000E-03
 H    7.159000      0.8671000      4.3000001E-03
 H   -7.158900     -0.8678000      5.2000000E-03
 H    6.990200      -1.605000      3.8999999E-03
 H   -6.990400       1.604300      4.3000001E-03


%chk=000013976-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000013976

0 1
O 2.588180 2.700065 0.000273
O -2.588189 -2.700129 0.000421
N 2.408340 -1.463574 0.000541
N -2.408351 1.463509 0.000609
C 1.244795 0.690276 0.000578
C -1.244807 -0.690341 0.000576
C 1.207218 -0.746726 0.000548
C -1.207231 0.746662 0.000580
C 0.036036 1.414230 0.000583
C -0.036048 -1.414296 0.000555
C 3.756829 0.577667 0.000455
C -3.756840 -0.577727 0.000535
C 3.662380 -0.851869 0.000435
C -3.662390 0.851809 0.000556
C 2.541323 1.422797 0.000645
C -2.541337 -1.422859 0.000614
C 5.044595 1.180265 0.000334
C -5.044606 -1.180326 0.000456
C 4.845901 -1.643699 0.000326
C -4.845913 1.643639 0.000522
C 6.210041 0.400066 0.000190
C -6.210052 -0.400122 0.000423
C 6.103013 -1.020091 0.000203
C -6.103024 1.020036 0.000453
H 0.109967 2.508456 0.000644
H -0.109979 -2.508523 0.000592
H 2.361546 -2.483973 0.000378
H -2.361556 2.483909 0.000650
H 5.083287 2.274777 0.000365
H -5.083299 -2.274838 0.000454
H 4.770177 -2.738002 0.000335
H -4.770183 2.737943 0.000555
H 7.195912 0.875396 0.000102
H -7.195925 -0.875450 0.000384
H 7.009154 -1.636203 0.000095
H -7.009165 1.636147 0.000434


